Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride
TL;DR: Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride (CAS 87236-35-9) is a chemical compound with molecular formula C11H12ClN5S and molecular weight 281.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole;hydrochloride
Also Known As: Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride, 2-(((5-Methyl-4H-1,2,4-triazol-3-yl)thio)methyl)benzimidazole hydrochloride, 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzim, 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole hydrochloride, 2-{[(5-Methyl-1H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,3-benzimidazole--hydrogen chloride (1/1)
| Molecular Formula | C11H12ClN5S |
|---|---|
| Molecular Weight | 281.05 g/mol |
| LogP | 2.70352 |
| Topological Polar Surface Area | 70.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.0502 |
| Heavy Atoms | 18 |
| Complexity | 614.477 |
Chemical Identifiers
| CAS Number | 87236-35-9 |
|---|---|
| SMILES | CC1=NC(=NN1)SCC2=NC3=CC=CC=C3N2.Cl |
Product Overview
Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride (CAS 87236-35-9), with molecular formula C11H12ClN5S and molecular weight 281.05 g/mol. IUPAC: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole;hydrochloride.
Chemical Property Profile of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride
Property Insights of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride
The XLogP value of 2.70352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride. The TPSA of 70.25 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride. Following Lipinski's Rule of Five, Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride has 2 hydrogen bond donor(s) and 4 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 Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride?
The CAS number of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride is 87236-35-9.
What is the molecular formula of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride?
The molecular formula of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride is C11H12ClN5S.
What is the molecular weight of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride?
The molecular weight of Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride is 281.05 g/mol.
Where can I buy Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride?
You can request a quote for Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 2-(((5-methyl-4H-1,2,4-triazol-3-yl)thio)methyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.