CAS RN: 613670-77-2

Faropenem Impurity

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Batchno.20250430 10mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS613670-77-2
  • Purity/Analytical Methods: >99.0%
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613670-77-2 / 5-[(2R)-oxolan-2-yl]-1,3-thiazole-4-carboxylic acid

Standard CAS: 613670-77-2 Multi CAS: No

Basic Information

CAS
613670-77-2
Multi CAS
No
Molecular Formula
C8H9NO3S
Molecular Weight
199.230000
Exact Mass
199.030314
InChI
InChI=1S/C8H9NO3S/c10-8(11)6-7(13-4-9-6)5-2-1-3-12-5/h4-5H,1-3H2,(H,10,11)/t5-/m1/s1
InChIKey
XZUWAHCIQCKWFP-RXMQYKEDSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
5
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
47
TPSA
59.42

LogP / Solubility

WLOGP
1.69
MLOGP
1.49
XLogP3
1
Consensus LogP
1.39
Log S (ESOL)
-2.29
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.6
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.73

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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