1H-indole, 3-chloro-1-(phenylsulfonyl)-
TL;DR: 1H-indole, 3-chloro-1-(phenylsulfonyl)- (CAS 108665-94-7) is a chemical compound with molecular formula C14H10ClNO2S and molecular weight 291.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)-3-chloroindole
Also Known As: 3-chloro-1-(phenylsulfonyl)-1H-indole, 1H-indole, 3-chloro-1-(phenylsulfonyl)-, 1-(benzenesulfonyl)-3-chloro-1H-indole, 3-chloro-1-phenylsulfonylindole, 1-(benzenesulfonyl)-3-chloroindole
| Molecular Formula | C14H10ClNO2S |
|---|---|
| Molecular Weight | 291.01 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 47.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.0121 |
| Heavy Atoms | 19 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 108665-94-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)Cl |
| InChIKey | UPPRTLFSJHQURM-UHFFFAOYSA-N |
Product Overview
1H-indole, 3-chloro-1-(phenylsulfonyl)- (CAS 108665-94-7), with molecular formula C14H10ClNO2S and molecular weight 291.01 g/mol. IUPAC: 1-(benzenesulfonyl)-3-chloroindole.
Chemical Property Profile of 1H-indole, 3-chloro-1-(phenylsulfonyl)-
Property Insights of 1H-indole, 3-chloro-1-(phenylsulfonyl)-
The XLogP value of 3.9 indicates that 1H-indole, 3-chloro-1-(phenylsulfonyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.5 Ų, 1H-indole, 3-chloro-1-(phenylsulfonyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-indole, 3-chloro-1-(phenylsulfonyl)- has 0 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 1H-indole, 3-chloro-1-(phenylsulfonyl)-?
The CAS number of 1H-indole, 3-chloro-1-(phenylsulfonyl)- is 108665-94-7.
What is the molecular formula of 1H-indole, 3-chloro-1-(phenylsulfonyl)-?
The molecular formula of 1H-indole, 3-chloro-1-(phenylsulfonyl)- is C14H10ClNO2S.
What is the molecular weight of 1H-indole, 3-chloro-1-(phenylsulfonyl)-?
The molecular weight of 1H-indole, 3-chloro-1-(phenylsulfonyl)- is 291.01 g/mol.
Where can I buy 1H-indole, 3-chloro-1-(phenylsulfonyl)-?
You can request a quote for 1H-indole, 3-chloro-1-(phenylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-indole, 3-chloro-1-(phenylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-indole, 3-chloro-1-(phenylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.