2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide
TL;DR: 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide (CAS 175201-50-0) is a chemical compound with molecular formula C5H5Cl2N3S and molecular weight 208.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,5-dichloroimidazol-1-yl)ethanethioamide
Also Known As: 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide, 2-(4,5-dichloroimidazol-1-yl)ethanethioamide, (4,5-Dichloroimidazol-1-yl)thioacetamide, 1H-Imidazole-1-ethanethioamide, 4,5-dichloro-, 2-(4,5-Dichloro-1H-imidazol-1-yl)thioacetamide
| Molecular Formula | C5H5Cl2N3S |
|---|---|
| Molecular Weight | 208.96 g/mol |
| LogP | 1.476 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.95813 |
| Heavy Atoms | 11 |
| Complexity | 283.25494 |
Chemical Identifiers
| CAS Number | 175201-50-0 |
|---|---|
| SMILES | C1=NC(=C(N1CC(=S)N)Cl)Cl |
Product Overview
2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide (CAS 175201-50-0), with molecular formula C5H5Cl2N3S and molecular weight 208.96 g/mol. IUPAC: 2-(4,5-dichloroimidazol-1-yl)ethanethioamide.
Chemical Property Profile of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide
Property Insights of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide
The XLogP value of 1.476 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide. With a topological polar surface area (TPSA) of 43.84 Ų, 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide 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 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide?
The CAS number of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide is 175201-50-0.
What is the molecular formula of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide?
The molecular formula of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide is C5H5Cl2N3S.
What is the molecular weight of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide?
The molecular weight of 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide is 208.96 g/mol.
Where can I buy 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide?
You can request a quote for 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.