4-Chloro-2-phenylsulfanyl-phenylamine
TL;DR: 4-Chloro-2-phenylsulfanyl-phenylamine (CAS 53692-01-6) is a chemical compound with molecular formula C12H10ClNS and molecular weight 235.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-phenylsulfanylaniline
Also Known As: 4-chloro-2-phenylsulfanylaniline, 4-chloro-2-phenylsulfanyl-aniline, Benzenamine, 4-chloro-2-(phenylthio)-, 4-Chloro-2-phenylsulfanyl-phenylamine
| Molecular Formula | C12H10ClNS |
|---|---|
| Molecular Weight | 235.02 g/mol |
| LogP | 4.0734 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.02225 |
| Heavy Atoms | 15 |
| Complexity | 456.43423 |
Chemical Identifiers
| CAS Number | 53692-01-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=C(C=CC(=C2)Cl)N |
Product Overview
4-Chloro-2-phenylsulfanyl-phenylamine (CAS 53692-01-6), with molecular formula C12H10ClNS and molecular weight 235.02 g/mol. IUPAC: 4-chloro-2-phenylsulfanylaniline.
Chemical Property Profile of 4-Chloro-2-phenylsulfanyl-phenylamine
Property Insights of 4-Chloro-2-phenylsulfanyl-phenylamine
The XLogP value of 4.0734 indicates that 4-Chloro-2-phenylsulfanyl-phenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 4-Chloro-2-phenylsulfanyl-phenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-phenylsulfanyl-phenylamine has 1 hydrogen bond donor(s) and 2 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 4-Chloro-2-phenylsulfanyl-phenylamine?
The CAS number of 4-Chloro-2-phenylsulfanyl-phenylamine is 53692-01-6.
What is the molecular formula of 4-Chloro-2-phenylsulfanyl-phenylamine?
The molecular formula of 4-Chloro-2-phenylsulfanyl-phenylamine is C12H10ClNS.
What is the molecular weight of 4-Chloro-2-phenylsulfanyl-phenylamine?
The molecular weight of 4-Chloro-2-phenylsulfanyl-phenylamine is 235.02 g/mol.
Where can I buy 4-Chloro-2-phenylsulfanyl-phenylamine?
You can request a quote for 4-Chloro-2-phenylsulfanyl-phenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-phenylsulfanyl-phenylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-phenylsulfanyl-phenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.