5-bromo-1-methyl-3H-indole-2-thione
TL;DR: 5-bromo-1-methyl-3H-indole-2-thione (CAS 110994-26-8) is a chemical compound with molecular formula C9H8BrNS and molecular weight 240.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-methyl-3H-indole-2-thione
Also Known As: 5-bromo-1-methyl-3H-indole-2-thione, 5-bromo-1,3-dihydro-1-methyl-2h-indole-2-thione, 5-bromo-1-methyl-2,3-dihydro-1H-indole-2-thione
| Molecular Formula | C9H8BrNS |
|---|---|
| Molecular Weight | 240.96 g/mol |
| LogP | 2.7688 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.95609 |
| Heavy Atoms | 12 |
| Complexity | 348.3818 |
Chemical Identifiers
| CAS Number | 110994-26-8 |
|---|---|
| SMILES | CN1C(=S)CC2=C1C=CC(=C2)Br |
Product Overview
5-bromo-1-methyl-3H-indole-2-thione (CAS 110994-26-8), with molecular formula C9H8BrNS and molecular weight 240.96 g/mol. IUPAC: 5-bromo-1-methyl-3H-indole-2-thione.
Chemical Property Profile of 5-bromo-1-methyl-3H-indole-2-thione
Property Insights of 5-bromo-1-methyl-3H-indole-2-thione
The XLogP value of 2.7688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-1-methyl-3H-indole-2-thione. With a topological polar surface area (TPSA) of 3.24 Ų, 5-bromo-1-methyl-3H-indole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-1-methyl-3H-indole-2-thione has 0 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-bromo-1-methyl-3H-indole-2-thione?
The CAS number of 5-bromo-1-methyl-3H-indole-2-thione is 110994-26-8.
What is the molecular formula of 5-bromo-1-methyl-3H-indole-2-thione?
The molecular formula of 5-bromo-1-methyl-3H-indole-2-thione is C9H8BrNS.
What is the molecular weight of 5-bromo-1-methyl-3H-indole-2-thione?
The molecular weight of 5-bromo-1-methyl-3H-indole-2-thione is 240.96 g/mol.
Where can I buy 5-bromo-1-methyl-3H-indole-2-thione?
You can request a quote for 5-bromo-1-methyl-3H-indole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-1-methyl-3H-indole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-1-methyl-3H-indole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.