CAS RN: 4750-28-1
N-(4-Chlorophenyl)benzenesulfonamide
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250702 | 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS4750-28-1
- Purity/Analytical Methods: >99.0%
4750-28-1 / N-(4-chlorophenyl)benzenesulfonamide
Basic Information
CAS
4750-28-1
Multi CAS
No
Molecular Formula
C12H10CLNO2S
Molecular Weight
267.730000
Exact Mass
267.012077
InChI
InChI=1S/C12H10ClNO2S/c13-10-6-8-11(9-7-10)14-17(15,16)12-4-2-1-3-5-12/h1-9,14H
InChIKey
ANRCRHLXUCJAKV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
12
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
68.7
TPSA
46.17
LogP / Solubility
WLOGP
3.14
MLOGP
2.77
XLogP3
2.9
Consensus LogP
2.94
Log S (ESOL)
-3.8
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.02
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.37
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.12
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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