1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone
TL;DR: 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone (CAS 29020-11-9) is a chemical compound with molecular formula C15H12N2OS and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-(2-sulfanylidene-3H-benzimidazol-1-yl)ethanone
Also Known As: 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone, 1-phenyl-2-(2-sulfanylbenzimidazolyl)ethan-1-one, 2-(2-Mercapto-benzoimidazol-1-yl)-1-phenyl-ethanone, 1-phenyl-2-(2-sulfanylidene-3H-benzimidazol-1-yl)ethanone, 2-(2-mercapto-1H-benzo[d]imidazol-1-yl)-1-phenylethanone
| Molecular Formula | C15H12N2OS |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.06705 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 29020-11-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3NC2=S |
| InChIKey | ZXZUKMKQRJQVRX-UHFFFAOYSA-N |
Product Overview
1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone (CAS 29020-11-9), with molecular formula C15H12N2OS and molecular weight 268.07 g/mol. IUPAC: 1-phenyl-2-(2-sulfanylidene-3H-benzimidazol-1-yl)ethanone.
Chemical Property Profile of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone
Property Insights of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone. Following Lipinski's Rule of Five, 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone has 1 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 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone?
The CAS number of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone is 29020-11-9.
What is the molecular formula of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone?
The molecular formula of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone is C15H12N2OS.
What is the molecular weight of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone?
The molecular weight of 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone is 268.07 g/mol.
Where can I buy 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone?
You can request a quote for 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-2-(2-sulfanyl-1H-benzimidazol-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.