咪唑-2-硫酮
TL;DR: 咪唑-2-硫酮 (CAS 49556-19-6) is a chemical compound with molecular formula C3H4N2S and molecular weight 100.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
咪唑-2-硫酮
1,3-dihydroimidazole-2-thione
Also Known As: 2-Mercaptoimidazole, 1H-Imidazole-2-thiol, 1H-Imidazole-2(3H)-thione, 1,3-Vinylenethiourea, Mercaptoimidazole
| Molecular Formula | C3H4N2S |
|---|---|
| Molecular Weight | 100.01 g/mol |
| LogP | 1.07229 |
| Topological Polar Surface Area | 31.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.00952 |
| Heavy Atoms | 6 |
| Complexity | 146.55606 |
Chemical Identifiers
| CAS Number | 49556-19-6 |
|---|---|
| SMILES | C1=CNC(=S)N1 |
Product Overview
咪唑-2-硫酮 (CAS 49556-19-6), with molecular formula C3H4N2S and molecular weight 100.01 g/mol. IUPAC: 1,3-dihydroimidazole-2-thione.
Chemical Property Profile of 咪唑-2-硫酮
Property Insights of 咪唑-2-硫酮
The XLogP value of 1.07229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 咪唑-2-硫酮. With a topological polar surface area (TPSA) of 31.58 Ų, 咪唑-2-硫酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 咪唑-2-硫酮 has 2 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 咪唑-2-硫酮?
The CAS number of 咪唑-2-硫酮 is 49556-19-6.
What is the molecular formula of 咪唑-2-硫酮?
The molecular formula of 咪唑-2-硫酮 is C3H4N2S.
What is the molecular weight of 咪唑-2-硫酮?
The molecular weight of 咪唑-2-硫酮 is 100.01 g/mol.
Where can I buy 咪唑-2-硫酮?
You can request a quote for 咪唑-2-硫酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 咪唑-2-硫酮?
Yes, KEHONG BIO provides custom synthesis services for 咪唑-2-硫酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.