CAS RN: 2903-37-9
N-(2-chloro-4-methylphenyl)-4-methyl-benzenesulfonamide(WS203339)
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260107 |
100mg / 250mg / 1g |
Out of stock |
8-10 business days | Inquiry |
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Product code:
starshine_CAS2903-37-9
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Purity/Analytical Methods:
>99.0%
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2903-37-9 / N-(2-chloro-4-methylphenyl)-4-methylbenzenesulfonamide
Standard CAS: 2903-37-9
Multi CAS: No
Basic Information
CAS
2903-37-9
Multi CAS
No
Molecular Formula
C14H14CLNO2S
Molecular Weight
295.800000
Exact Mass
295.043378
InChI
InChI=1S/C14H14ClNO2S/c1-10-3-6-12(7-4-10)19(17,18)16-14-8-5-11(2)9-13(14)15/h3-9,16H,1-2H3
InChIKey
RCQMCSRFEXHYPC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
78.18
TPSA
46.17
LogP / Solubility
WLOGP
3.76
MLOGP
3.32
XLogP3
3.4
Consensus LogP
3.49
Log S (ESOL)
-4.31
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.7
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.06
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.86
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5