6-methanesulfonyl-1H-indole
TL;DR: 6-methanesulfonyl-1H-indole (CAS 467461-40-1) is a chemical compound with molecular formula C9H9NO2S and molecular weight 195.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylsulfonyl-1H-indole
Also Known As: 6-(Methylsulfonyl)-1H-indole, 6-methanesulfonyl-1H-indole, 6-methylsulfonyl-1H-indole, 6-methylsulfonylindole, 6-(methylsulfonyl)indole
| Molecular Formula | C9H9NO2S |
|---|---|
| Molecular Weight | 195.04 g/mol |
| LogP | 1.5714 |
| Topological Polar Surface Area | 49.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.0354 |
| Heavy Atoms | 13 |
| Complexity | 539.495 |
Chemical Identifiers
| CAS Number | 467461-40-1 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC2=C(C=C1)C=CN2 |
Product Overview
6-methanesulfonyl-1H-indole (CAS 467461-40-1), with molecular formula C9H9NO2S and molecular weight 195.04 g/mol. IUPAC: 6-methylsulfonyl-1H-indole.
Chemical Property Profile of 6-methanesulfonyl-1H-indole
Property Insights of 6-methanesulfonyl-1H-indole
The XLogP value of 1.5714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methanesulfonyl-1H-indole. With a topological polar surface area (TPSA) of 49.93 Ų, 6-methanesulfonyl-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methanesulfonyl-1H-indole 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 6-methanesulfonyl-1H-indole?
The CAS number of 6-methanesulfonyl-1H-indole is 467461-40-1.
What is the molecular formula of 6-methanesulfonyl-1H-indole?
The molecular formula of 6-methanesulfonyl-1H-indole is C9H9NO2S.
What is the molecular weight of 6-methanesulfonyl-1H-indole?
The molecular weight of 6-methanesulfonyl-1H-indole is 195.04 g/mol.
Where can I buy 6-methanesulfonyl-1H-indole?
You can request a quote for 6-methanesulfonyl-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methanesulfonyl-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 6-methanesulfonyl-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.