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CAS 324757-50-8 R-CLOPIDOGREL CARBOXYLIC ACID molecular structure lightbox
CAS RN: 324757-50-8

R-CLOPIDOGREL CARBOXYLIC ACID

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250303 1mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS324757-50-8
  • Purity/Analytical Methods: >99.0%
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324757-50-8 / 2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetic acid

Standard CAS: 324757-50-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
324757-50-8
Multi CAS
Yes
Molecular Formula
C15H14CLNO2S
Molecular Weight
307.800000
Exact Mass
307.043378
InChI
InChI=1S/C15H14ClNO2S/c16-12-4-2-1-3-11(12)14(15(18)19)17-7-5-13-10(9-17)6-8-20-13/h1-4,6,8,14H,5,7,9H2,(H,18,19)/t14-/m1/s1
InChIKey
DCASRSISIKYPDD-CQSZACIVSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
11
Fraction Csp3
0.27
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
80.26
TPSA
40.54

LogP / Solubility

WLOGP
3.59
MLOGP
3.17
XLogP3
1.1
Consensus LogP
2.62
Log S (ESOL)
-4.22
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.67
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.05

Drug-likeness / Medicinal Chemistry

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

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