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[ CAS No. 1235993-31-3 ] 6-Fluoroimidazo[1,2-a]pyridin-3-amine

Cat. No.: A610502
Chemical Structure| 1235993-31-3
Chemical Structure| 1235993-31-3
Structure of 1235993-31-3 * Storage: Keep in dark place,Inert atmosphere,2-8°C
Purity Size Price USA Stock *0-1 Day Global Stock *5-7 Days Quantity
97% 50mg $61.00 Inquiry Inquiry
97% 100mg $80.00 Inquiry Inquiry
97% 250mg $98.00 Inquiry Inquiry
97% 1g $391.00 Inquiry Inquiry

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* Storage: Keep in dark place,Inert atmosphere,2-8°C

* Shipping: Normal

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Product Details of [ 1235993-31-3 ]

CAS No. :1235993-31-3 MDL No. :MFCD20726782
Formula : C7H6FN3 Boiling Point : -
Linear Structure Formula :- InChI Key :DBKKYQIWVODMIZ-UHFFFAOYSA-N
M.W : 151.14 Pubchem ID :67002292
Synonyms :

Calculated chemistry of [ 1235993-31-3 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 11
Num. arom. heavy atoms : 9
Fraction Csp3 : 0.0
Num. rotatable bonds : 0
Num. H-bond acceptors : 2.0
Num. H-bond donors : 1.0
Molar Refractivity : 39.55
TPSA : 43.32 Ų

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -6.15 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.36
Log Po/w (XLOGP3) : 1.51
Log Po/w (WLOGP) : 1.48
Log Po/w (MLOGP) : 0.95
Log Po/w (SILICOS-IT) : 0.65
Consensus Log Po/w : 1.19

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 1.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -2.33
Solubility : 0.701 mg/ml ; 0.00464 mol/l
Class : Soluble
Log S (Ali) : -2.03
Solubility : 1.42 mg/ml ; 0.00938 mol/l
Class : Soluble
Log S (SILICOS-IT) : -1.99
Solubility : 1.55 mg/ml ; 0.0103 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.88

Safety of [ 1235993-31-3 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P280-P305+P351+P338 UN#:N/A
Hazard Statements:H302 Packing Group:N/A
GHS Pictogram:
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