![1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol structure](/static/products/5377/537702-07-1.webp)
1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol
TL;DR: 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol (CAS 537702-07-1) is a chemical compound with molecular formula C15H14N2S and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-methylphenyl)methyl]-1H-benzimidazole-2-thione
Also Known As: 1-[(2-methylphenyl)methyl]-1H-1,3-benzodiazole-2-thiol, 1-[(2-methylphenyl)methyl]benzimidazole-2-thiol, 1-(2-methylbenzyl)-1H-benzimidazole-2-thiol, BAS 06706746, 3-[(2-methylphenyl)methyl]-1H-benzimidazole-2-thione
| Molecular Formula | C15H14N2S |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 47.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.08777 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 537702-07-1 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C3=CC=CC=C3NC2=S |
| InChIKey | NCYUAELAOBQQKJ-UHFFFAOYSA-N |
Product Overview
1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol (CAS 537702-07-1), with molecular formula C15H14N2S and molecular weight 254.09 g/mol. IUPAC: 3-[(2-methylphenyl)methyl]-1H-benzimidazole-2-thione.
Chemical Property Profile of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol
Property Insights of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol
The XLogP value of 3.2 indicates that 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.4 Ų, 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol 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 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol?
The CAS number of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol is 537702-07-1.
What is the molecular formula of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol?
The molecular formula of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol is C15H14N2S.
What is the molecular weight of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol?
The molecular weight of 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol is 254.09 g/mol.
Where can I buy 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol?
You can request a quote for 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Methylphenyl)methyl]benzimidazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.