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[ CAS No. 59143-60-1 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
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There will be a HazMat fee per item when shipping a dangerous goods. The HazMat fee will be charged to your UPS/DHL/FedEx collect account or added to the invoice unless the package is shipped via Ground service. Ship by air in Excepted Quantity (each bottle), which is up to 1g/1mL for class 6.1 packing group I or II, and up to 25g/25ml for all other HazMat items.

Type HazMat fee for 500 gram (Estimated)
Excepted Quantity USD 0.00
Limited Quantity USD 15-60
Inaccessible (Haz class 6.1), Domestic USD 80+
Inaccessible (Haz class 6.1), International USD 150+
Accessible (Haz class 3, 4, 5 or 8), Domestic USD 100+
Accessible (Haz class 3, 4, 5 or 8), International USD 200+
Chemical Structure| 59143-60-1
Chemical Structure| 59143-60-1
Structure of 59143-60-1 * Storage: {[proInfo.prStorage]}
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Product Details of [ 59143-60-1 ]

CAS No. :59143-60-1 MDL No. :MFCD00153937
Formula : C16H19N3O8SZn Boiling Point : -
Linear Structure Formula :- InChI Key :-
M.W : 478.81 Pubchem ID :-
Synonyms :
Cephalosporin C (zinc)

Calculated chemistry of [ 59143-60-1 ]

Physicochemical Properties

Num. heavy atoms : 29
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.56
Num. rotatable bonds : 11
Num. H-bond acceptors : 9.0
Num. H-bond donors : 2.0
Molar Refractivity : 95.58
TPSA : 207.29 Ų

Pharmacokinetics

GI absorption : Low
BBB permeant : No
P-gp substrate : Yes
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -12.37 cm/s

Lipophilicity

Log Po/w (iLOGP) : -43.16
Log Po/w (XLOGP3) : -4.43
Log Po/w (WLOGP) : -4.18
Log Po/w (MLOGP) : -2.94
Log Po/w (SILICOS-IT) : -0.88
Consensus Log Po/w : -11.12

Druglikeness

Lipinski : 1.0
Ghose : None
Veber : 2.0
Egan : 1.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : 0.71
Solubility : 2450.0 mg/ml ; 5.11 mol/l
Class : Highly soluble
Log S (Ali) : 0.69
Solubility : 2360.0 mg/ml ; 4.93 mol/l
Class : Highly soluble
Log S (SILICOS-IT) : -0.43
Solubility : 179.0 mg/ml ; 0.374 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 2.0
Synthetic accessibility : 4.83

Safety of [ 59143-60-1 ]

Signal Word:Danger Class:6.1
Precautionary Statements:P261-P272-P280-P284-P302+P352-P333+P313 UN#:2811
Hazard Statements:H317-H334 Packing Group:
GHS Pictogram:
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