1-Phenyl-1H-benzimidazol-2-YL hydrosulfide
TL;DR: 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide (CAS 4493-32-7) is a chemical compound with molecular formula C13H10N2S and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-1H-benzimidazole-2-thione
Also Known As: 1-Phenyl-1H-benzoimidazole-2-thiol, 1-phenyl-1H-benzo[d]imidazole-2-thiol, 3-phenyl-1H-benzimidazole-2-thione, 1-phenylbenzimidazole-2-thiol, 2H-Benzimidazole-2-thione, 1,3-dihydro-1-phenyl-
| Molecular Formula | C13H10N2S |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 47.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.05647 |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 4493-32-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3=CC=CC=C3NC2=S |
| InChIKey | JKIGHOGKGARVAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-1H-benzimidazol-2-YL hydrosulfide (CAS 4493-32-7), with molecular formula C13H10N2S and molecular weight 226.06 g/mol. IUPAC: 3-phenyl-1H-benzimidazole-2-thione.
Chemical Property Profile of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide
Property Insights of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide. With a topological polar surface area (TPSA) of 47.4 Ų, 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide 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-Phenyl-1H-benzimidazol-2-YL hydrosulfide?
The CAS number of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide is 4493-32-7.
What is the molecular formula of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide?
The molecular formula of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide is C13H10N2S.
What is the molecular weight of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide?
The molecular weight of 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide is 226.06 g/mol.
Where can I buy 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide?
You can request a quote for 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-1H-benzimidazol-2-YL hydrosulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.