1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride
TL;DR: 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride (CAS 64398-12-5) is a chemical compound with molecular formula C10H12Cl2N2S and molecular weight 262.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloroethylsulfanylmethyl)-1H-benzimidazole;hydrochloride
Also Known As: 1H-Benzimidazole, monohydrochloride, 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride, 2-(((2-Chloroethyl)thio)methyl)-1H-benzimidazole monohydrochloride, 2-(2-chloroethylsulfanylmethyl)-1H-benzimidazole hydrochloride, 2-(2-chloroethylsulfanylmethyl)-1H-benzimidazole,hydrochloride
| Molecular Formula | C10H12Cl2N2S |
|---|---|
| Molecular Weight | 262.01 g/mol |
| LogP | 3.4567 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.00983 |
| Heavy Atoms | 15 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 64398-12-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)CSCCCl.Cl |
| InChIKey | JQKIQDHDEGYBLY-UHFFFAOYSA-N |
Product Overview
1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride (CAS 64398-12-5), with molecular formula C10H12Cl2N2S and molecular weight 262.01 g/mol. IUPAC: 2-(2-chloroethylsulfanylmethyl)-1H-benzimidazole;hydrochloride.
Chemical Property Profile of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride
Property Insights of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride
The XLogP value of 3.4567 indicates that 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride has 2 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 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride?
The CAS number of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride is 64398-12-5.
What is the molecular formula of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride?
The molecular formula of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride is C10H12Cl2N2S.
What is the molecular weight of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride?
The molecular weight of 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride is 262.01 g/mol.
Where can I buy 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride?
You can request a quote for 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole, 2-(((2-chloroethyl)thio)methyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.