5-Chloro-3-(phenylthio)-indole
TL;DR: 5-Chloro-3-(phenylthio)-indole (CAS 227803-35-2) is a chemical compound with molecular formula C14H10ClNS and molecular weight 259.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-phenylsulfanyl-1H-indole
Also Known As: 5-Chloro-3-(phenylthio)-indole, 5-chloro-3-(phenylthio)-1h-indole, 5-chloro-3-phenylsulfanyl-1H-indole, 5-Chloro-3-phenylthio-1H-indole, 3,5-DIMETHYLTRIPHENYLAMINE
| Molecular Formula | C14H10ClNS |
|---|---|
| Molecular Weight | 259.02 g/mol |
| LogP | 4.9725 |
| Topological Polar Surface Area | 15.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.02225 |
| Heavy Atoms | 17 |
| Complexity | 645.6359 |
Chemical Identifiers
| CAS Number | 227803-35-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CNC3=C2C=C(C=C3)Cl |
Product Overview
5-Chloro-3-(phenylthio)-indole (CAS 227803-35-2), with molecular formula C14H10ClNS and molecular weight 259.02 g/mol. IUPAC: 5-chloro-3-phenylsulfanyl-1H-indole.
Chemical Property Profile of 5-Chloro-3-(phenylthio)-indole
Property Insights of 5-Chloro-3-(phenylthio)-indole
The XLogP value of 4.9725 indicates that 5-Chloro-3-(phenylthio)-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.79 Ų, 5-Chloro-3-(phenylthio)-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-3-(phenylthio)-indole has 1 hydrogen bond donor(s) and 1 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 5-Chloro-3-(phenylthio)-indole?
The CAS number of 5-Chloro-3-(phenylthio)-indole is 227803-35-2.
What is the molecular formula of 5-Chloro-3-(phenylthio)-indole?
The molecular formula of 5-Chloro-3-(phenylthio)-indole is C14H10ClNS.
What is the molecular weight of 5-Chloro-3-(phenylthio)-indole?
The molecular weight of 5-Chloro-3-(phenylthio)-indole is 259.02 g/mol.
Where can I buy 5-Chloro-3-(phenylthio)-indole?
You can request a quote for 5-Chloro-3-(phenylthio)-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-3-(phenylthio)-indole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-3-(phenylthio)-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.