Imidazole-2-thiol, 1-butyl-
TL;DR: Imidazole-2-thiol, 1-butyl- (CAS 10583-85-4) is a chemical compound with molecular formula C7H12N2S and molecular weight 156.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butyl-1H-imidazole-2-thione
Also Known As: Imidazole-2-thiol, 1-butyl-, 1-n-Butyl-2-mercaptoimidazole, 3-butyl-1H-imidazole-2-thione, Imidazole, 1-n-butyl-2-mercapto-, 1-Butyl-4-imidazoline-2-thione
| Molecular Formula | C7H12N2S |
|---|---|
| Molecular Weight | 156.07 g/mol |
| LogP | 2.34579 |
| Topological Polar Surface Area | 20.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.07211 |
| Heavy Atoms | 10 |
| Complexity | 235.75418 |
Chemical Identifiers
| CAS Number | 10583-85-4 |
|---|---|
| SMILES | CCCCN1C=CNC1=S |
Product Overview
Imidazole-2-thiol, 1-butyl- (CAS 10583-85-4), with molecular formula C7H12N2S and molecular weight 156.07 g/mol. IUPAC: 3-butyl-1H-imidazole-2-thione.
Chemical Property Profile of Imidazole-2-thiol, 1-butyl-
Property Insights of Imidazole-2-thiol, 1-butyl-
The XLogP value of 2.34579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole-2-thiol, 1-butyl-. With a topological polar surface area (TPSA) of 20.72 Ų, Imidazole-2-thiol, 1-butyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazole-2-thiol, 1-butyl- 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 Imidazole-2-thiol, 1-butyl-?
The CAS number of Imidazole-2-thiol, 1-butyl- is 10583-85-4.
What is the molecular formula of Imidazole-2-thiol, 1-butyl-?
The molecular formula of Imidazole-2-thiol, 1-butyl- is C7H12N2S.
What is the molecular weight of Imidazole-2-thiol, 1-butyl-?
The molecular weight of Imidazole-2-thiol, 1-butyl- is 156.07 g/mol.
Where can I buy Imidazole-2-thiol, 1-butyl-?
You can request a quote for Imidazole-2-thiol, 1-butyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole-2-thiol, 1-butyl-?
Yes, KEHONG BIO provides custom synthesis services for Imidazole-2-thiol, 1-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.