Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-
TL;DR: Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- (CAS 70146-09-7) is a chemical compound with molecular formula C13H12ClNO2S and molecular weight 281.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-(4-methylphenyl)sulfonylaniline
Also Known As: 5-chloro-2-[ sulphonyl]aniline, Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-, 5-Chloro-2-((p-tolyl)sulphonyl)aniline, 5-chloro-2-(4-methylphenyl)sulfonylaniline, 5-CHLORO-2-[(P-TOLYL)SULPHONYL]ANILINE
| Molecular Formula | C13H12ClNO2S |
|---|---|
| Molecular Weight | 281.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.02774 |
| Heavy Atoms | 18 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 70146-09-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)Cl)N |
| InChIKey | YDSSEPWFAJNLSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- (CAS 70146-09-7), with molecular formula C13H12ClNO2S and molecular weight 281.03 g/mol. IUPAC: 5-chloro-2-(4-methylphenyl)sulfonylaniline.
Chemical Property Profile of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-
Property Insights of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-. Following Lipinski's Rule of Five, Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-?
The CAS number of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- is 70146-09-7.
What is the molecular formula of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-?
The molecular formula of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- is C13H12ClNO2S.
What is the molecular weight of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-?
The molecular weight of Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- is 281.03 g/mol.
Where can I buy Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-?
You can request a quote for Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 5-chloro-2-[(4-methylphenyl)sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.