5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione
TL;DR: 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione (CAS 71806-06-9) is a chemical compound with molecular formula C8H6Cl2N2S and molecular weight 231.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dichloro-3-methyl-1H-benzimidazole-2-thione
Also Known As: 5,6-dichloro-3-methyl-1H-benzimidazole-2-thione, 5,6-dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione, 5,6-dichloro-1-methyl-1H-1,3-benzodiazole-2-thiol, 5,6-Dichloro-1-methyl-3h-benzoimidazole-2-thione, 5,6-dichloro-1-methyl-1H-benzo[d]imidazole-2-thiol
| Molecular Formula | C8H6Cl2N2S |
|---|---|
| Molecular Weight | 231.96 g/mol |
| LogP | 3.54269 |
| Topological Polar Surface Area | 20.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 231.96288 |
| Heavy Atoms | 13 |
| Complexity | 526.65894 |
Chemical Identifiers
| CAS Number | 71806-06-9 |
|---|---|
| SMILES | CN1C2=CC(=C(C=C2NC1=S)Cl)Cl |
Product Overview
5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione (CAS 71806-06-9), with molecular formula C8H6Cl2N2S and molecular weight 231.96 g/mol. IUPAC: 5,6-dichloro-3-methyl-1H-benzimidazole-2-thione.
Chemical Property Profile of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione
Property Insights of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione
The XLogP value of 3.54269 indicates that 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.72 Ų, 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione 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 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione?
The CAS number of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione is 71806-06-9.
What is the molecular formula of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione?
The molecular formula of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione is C8H6Cl2N2S.
What is the molecular weight of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione?
The molecular weight of 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione is 231.96 g/mol.
Where can I buy 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione?
You can request a quote for 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dichloro-1-methyl-1,3-dihydro-2H-benzimidazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.