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Chemical Structure| 19387-91-8 Chemical Structure| 19387-91-8

Structure of Tinidazole
CAS No.: 19387-91-8

Chemical Structure| 19387-91-8

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Tinidazole is a nitroimidazole alkylating broad-spectrum antimicrobial agent used in the treatment of bacterial, protozoal and parasitic infections.

Synonyms: CP 12,574; CP12574; Tricolam

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Product Citations

Product Citations

Gosecki, Mateusz ; Urbaniak, Malgorzata ; Martinho, Nuno ; Gosecka, Monika ; Zloh, Mire ;

Abstract: Polymers, including non-linear copolymers, have great potential in the development of drug delivery systems with many advantages, but the design requires optimizing polymer-drug interactions. Mol. dynamics (MD) simulations can provide insights into polymer-drug interactions for designing delivery systems, but mimicking formulation processes such as drying is often not included in in silico studies. This study demonstrates an MD approach to model drying of systems comprising either hydrophilic tinidazole or hydrophobic clotrimazole drugs with amphiphilic hyperbranched copolyethers. The simulated drying protocol was critical for elucidating drug encapsulation and binding mechanisms. Exptl., two polymers were synthesized and shown to encapsulate clotrimazole with up to 83% efficiency, guided by interactions with the hydrophobic core observed in simulations. In contrast, tinidazole is associated with surface regions, indicating capacity differences between drug types. Overall, this work highlights MD simulation of the drying process as an important tool for predicting drug-polymer complex behavior. The modelled formulation protocol enabled high encapsulation efficiency and opened possibilities for the design of delivery systems based on computationally derived binding mechanisms. This demonstrates a computational-exptl. approach where simulated drying was integral to elucidating interactions and developing optimized complexes, emphasizing the value of mol. modeling for the development of drug delivery formulations.

Keywords: hydrophobic drug ; encapsulation ; molecular dynamics simulation ; clotrimazole ; unimolecular micelles ; star-hyperbranched copolymer ; polyether

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Alternative Products

Product Details of Tinidazole

CAS No. :19387-91-8
Formula : C8H13N3O4S
M.W : 247.27
SMILES Code : O=[N+](C1=CN=C(C)N1CCS(=O)(CC)=O)[O-]
Synonyms :
CP 12,574; CP12574; Tricolam
MDL No. :MFCD00057217
InChI Key :HJLSLZFTEKNLFI-UHFFFAOYSA-N
Pubchem ID :5479

Safety of Tinidazole

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Isoform Comparison

Biological Activity

Clinical Trial:

NCT Number Conditions Phases Recruitment Completion Date Locations
NCT02934048 Therapeutic Duration ... More >> Helicobacter Pylori Antimicrobial Susceptibility Test Eradication Less << Phase 4 Unknown June 2017 -
NCT03139253 Antimicrobial Susceptibility T... More >>esting Triple Therapy Less << Phase 4 Not yet recruiting June 30, 2017 -
NCT03124420 Helicobacter Pylori Infection Phase 4 Completed - Taiwan ... More >> Division of Gastroenterology and Department of Internal Medicine, Mackay Memorial Hospital, Taipei, Taiwan Taipei, Taiwan, 10449 Less <<
NCT03516669 Helicobacter Pylori Infection Phase 4 Recruiting October 26, 2019 Taiwan ... More >> Division of Gastroenterology and Department of Internal Medicine, Mackay Memorial Hospital, Taipei, Taiwan Recruiting Taipei, Taiwan, 10449 Contact: Tai-cherng Liou, MD    886-2-25433535 ext 3990    mmhltc@gmail.com Less <<
NCT03521726 Helicobacter Pylori Infection Phase 4 Recruiting October 26, 2019 Taiwan ... More >> Division of Gastroenterology and Department of Internal Medicine, Mackay Memorial Hospital, Taipei, Taiwan Recruiting Taipei, Taiwan, 10449 Contact: Tai-cherng Liou, MD    886-2-25433535 ext 3990    mmhltc@gmail.com Less <<
NCT02988089 Helicobacter Pylori Infection ... More >> Antimicrobial Susceptibility Testing Less << Phase 4 Recruiting September 2017 China, Shandong ... More >> Department of Gastroenterology, Qilu Hospital, Shandong University Recruiting Ji'nan, Shandong, China, 250012 Contact: Yanqing Li, MD, PhD    86-531-82169236    liyanqing@sdu.edu.cn    Contact: Yanqing Li, MD, PhD    86-0531-82169236    liyanqing@sdu.edu.cn Less <<
NCT03524833 Helicobacter Pylori Infection Phase 4 Not yet recruiting October 26, 2019 Taiwan ... More >> Division of Gastroenterology and Department of Internal Medicine, Mackay Memorial Hospital, Taipei, Taiwan Taipei, Taiwan, 10449 Less <<
NCT03571230 Helicobacter Pylori Infection ... More >> Antimicrobial Susceptibility Testing Less << Phase 4 Not yet recruiting January 30, 2020 China, Shandong ... More >> Xiuli Zuo Not yet recruiting Jinan, Shandong, China Contact: Xiuli Zuo, PhD,MD    15588818685 ext 053188369277    zuoxiuli@sina.com    Sub-Investigator: Jing Liu, MD          Sub-Investigator: Chaoran Ji, MD Less <<
NCT00003617 Gastric Cancer Phase 3 Unknown - Hong Kong ... More >> Queen Mary Hospital Hong Kong, Hong Kong Poland Oncology Centre Institute Warsaw, Poland, 02 781 South Africa Frere Hospital Central Region, South Africa Switzerland Ospedale San Giovanni Bellinzona, Switzerland, CH-6500 United Kingdom Stoke Mandeville Hospital Aylesbury-Buckinghamshire, England, United Kingdom, HP21 8AL Bradford Hospitals NHS Trust Bradford, England, United Kingdom, BD9 6RJ Kent and Canterbury Hospital Canterbury, England, United Kingdom, CT2 7NR Essex County Hospital Colchester, England, United Kingdom Walsgrave Hospital Coventry, England, United Kingdom, CV2 2DX Royal Free Hospital Hampstead, London, England, United Kingdom, NW3 2QG Ipswich Hospital NHS Trust Ipswich, England, United Kingdom, IP4 5PD Leeds Teaching Hospital Trust Leeds, England, United Kingdom, LS1 3EX Charing Cross Hospital London, England, United Kingdom, W6 8RF Middlesex Hospital- Meyerstein Institute London, England, United Kingdom, WIT 3AA Clatterbridge Centre for Oncology NHS Trust Merseyside, England, United Kingdom, L63 4JY Milton Keynes General Hospital Milton Keynes, England, United Kingdom, MK6 5LD Mount Vernon Hospital Northwood, England, United Kingdom, HA6 2RN Nottingham City Hospital NHS Trust Nottingham, England, United Kingdom, NG5 1PB Peterborough Hospitals Trust Peterborough, England, United Kingdom, PE3 6DA Salford Royal Hospitals NHS Trust Salford, England, United Kingdom, M6 8HD Weston Park Hospital Sheffield, England, United Kingdom, S1O 2SJ Royal Marsden Hospital Sutton, England, United Kingdom, SM2 5PT Good Hope Hospital Trust West Midlands, England, United Kingdom, B75 7RR Southend NHS Trust Hospital Westcliff-On-Sea, England, United Kingdom York District Hospital York, England, United Kingdom, Y031 8HE Kettering General Hosptial Kettering, Northants, United Kingdom, NNI6 8UZ James Paget Hospital Norfolk, United Kingdom, NR31 6LA Rotherham District General Hospital-NHS Trust Rotherham, United Kingdom, S60 2UD Salisbury District Hospital Salisbury, United Kingdom, SP2 8BJ Staffordshire General Hospital Stafford, United Kingdom, ST16 3SA Less <<
NCT03565484 Helicobacter Pylori Infection Phase 4 Not yet recruiting April 30, 2020 China, Shandong ... More >> Qilu hosipital Not yet recruiting Jinan, Shandong, China, 257000 Contact: Xiuli Zuo, MD,PhD    15588818685 ext 053188369277    zuoxiuli@sina.com    Sub-Investigator: Chaoran Ji, MD          Sub-Investigator: Jing Liu, MD Less <<
NCT03412071 Foreskin HIV Susceptibility Not Applicable Recruiting December 7, 2019 Uganda ... More >> UVRI-IAVI HIV Vaccine Program Recruiting Entebbe, Wakiso, Uganda Contact: Bernard S Bagaya, PhD    +256787082820    bbagaya@iavi.or.ug Less <<
NCT02776371 Helicobacter Pylori Eradicatio... More >>n Rate Less << Phase 4 Completed - China, Shandong ... More >> Department of Gastroenterology, Qilu Hospital, Shandong University Jinan, Shandong, China, 250012 Less <<
NCT00403364 Helicobacter Pylori Infection Phase 2 Phase 3 Completed - Italy ... More >> S.Orsola/Malpighi Teaching Hospital, University Bologna, Italy, 40138 Less <<
NCT03658746 Helicobacter Pylori Infection Phase 4 Not yet recruiting April 30, 2020 China, Shandong ... More >> Qilu hosipital Jinan, Shandong, China, 257000 Less <<
NCT02648698 Chronic Endometritis Not Applicable Unknown December 2017 China, Beijing ... More >> FuXing Hospital,Capital Medical University Recruiting Beijing, Beijing, China, 100038 Contact: Dongmei Song, MD    008613651294056    echosdm@163.com    Contact: Qin Zhong    00861088062944    fxyykjk@sina.com    Sub-Investigator: Tinchiu Li, PhD          Sub-Investigator: Enlan Xia, MD Less <<
NCT01042184 H. Pylori Infection Phase 4 Completed - Taiwan ... More >> National Taiwan University Hospital Taipei, Taiwan, 10002 Less <<
NCT03021590 Helicobacter Pylori Gastrointe... More >>stinal Tract Infection Less << Phase 4 Withdrawn(No Participants Enro... More >>lled) Less << January 31, 2022 Syrian Arab Republic ... More >> Damascus Hospital Damascus, Syrian Arab Republic, +963 Less <<
NCT01481844 Optimization of Second Line Tr... More >>eatment Protocol for H Pylori Eradication Less << Phase 3 Completed - Israel ... More >> Soroca UMC Beer-Sheva, Israel Less <<
NCT01544517 Helicobacter Pylori Infection Phase 3 Completed - Italy ... More >> Dipartimento di Internistica Clinica e Sperimentale, SUN Naples, Napoli, Italy, 80131 Less <<
NCT02711176 Helicobacter Infection Phase 4 Completed - Iran, Islamic Republic of ... More >> Ilam University of Medical Scienvc Ilam, Iran, Islamic Republic of, 6939177143 Less <<
NCT01070277 Chronic Diarrhea ... More >> Abdominal Pain Bloating Less << Not Applicable Unknown December 2016 Israel ... More >> Chaim Sheba Medical Center, Tel Hashomer, Israel Not yet recruiting Ramat Gan, Israel Contact: Eli Schwartz, MD    ++97235308456    elischwa@post.tau.ac.il    Sheba Medical Center Recruiting Ramat-Gan, Israel Contact: Eli Schwartz, M.D    +972-35308456    Eli.schwartz@sheba.health.gov.il Less <<
NCT00313131 Bacterial Vaginosis ... More >> Candidiasis Vaginitis Less << Phase 3 Completed - Ghana ... More >> Adabraka Polyclinic Accra, Ghana Suntreso Polyclinc Kumasi, Ghana Guinea Centre de Santé Carrière Conakry, Guinea Centre de Santé Madina Conakry, Guinea Togo Centre de Santé d'Adakpamé Adakpame, Togo Clinique IST d'Agoe Nyivé Lomé, Togo Clinique IST d'Amoutivé Lomé, Togo Less <<
NCT00229216 Bacterial Vaginosis PHASE3 COMPLETED 2025-06-07 Duke University School of Medi... More >>cine, Durham, North Carolina, 27710, United States Less <<
NCT02942485 GIARDIASIS Phase 4 Recruiting January 2019 Finland ... More >> Children's Hospital, HYKS Recruiting Helsinki, Finland Contact: Svetlana Vakkilainen       svetlana.vakkilainen@hus.fi Less <<
NCT00322465 Urethritis Phase 2 Completed - United States, Alabama ... More >> University of Alabama Hospital - Infectious Diseases Birmingham, Alabama, United States, 35249-0001 United States, Louisiana Delgado Personal Health Center New Orleans, Louisiana, United States, 70112-3503 United States, Maryland Johns Hopkins Hospital - Emergency Medicine Baltimore, Maryland, United States, 21287-0005 United States, North Carolina University of North Carolina School of Medicine - Center for Infectious Diseases Chapel Hill, North Carolina, United States, 27599-7030 Less <<
NCT00811096 Malaria, Vivax Phase 2 Completed - Thailand ... More >> Malaria Research Unit, 68/30 Ban Toong Road, P.O. Box 46 Mae Sot, 63110, Tak, Thailand Less <<
NCT00510614 Bacterial Vaginosis Early Phase 1 Completed - United States, Pennsylvania ... More >> Magee-Womens Hospital of UPMC Pittsburgh, Pennsylvania, United States, 15213 Less <<
NCT01591889 Trichomoniasis Phase 1 Completed - United States, Texas ... More >> Novum Pharmaceutical Research Services Houston, Texas, United States, 77042 Less <<
NCT00322465 - Completed - -
NCT00324142 Recurrent Bacterial Vaginosis Phase 2 Withdrawn(Study Terminated Pre... More >>maturely) Less << - United States, California ... More >> Kaiser Permanente San Francisco, California, United States, 94115 Less <<
NCT00787553 Hysterectomy Not Applicable Unknown December 2008 Brazil ... More >> University of Campinas Campinas, SP, Brazil, 13083-970 Less <<
NCT00334633 Bacterial Vaginosis Phase 4 Completed - United States, Alabama ... More >> Jefferson County Department of Health STD Clinic Birmingham, Alabama, United States, 35294 Less <<
NCT00334633 - Completed - -

Protocol

Bio Calculators
Preparing Stock Solutions 1mg 5mg 10mg

1 mM

5 mM

10 mM

4.04mL

0.81mL

0.40mL

20.22mL

4.04mL

2.02mL

40.44mL

8.09mL

4.04mL

References

 

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