2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide
TL;DR: 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide (CAS 344896-57-7) is a chemical compound with molecular formula C16H14N4O3S and molecular weight 342.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide
Also Known As: 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide, 2-(2-(methylthio)-1H-benzo[d]imidazol-1-yl)-N-(3-nitrophenyl)acetamide, 2-[2-(methylsulfanyl)-1H-benzimidazol-1-yl]-N-(3-nitrophenyl)acetamide, Cambridge id 7023331
| Molecular Formula | C16H14N4O3S |
|---|---|
| Molecular Weight | 342.08 g/mol |
| LogP | 3.3051 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.07867 |
| Heavy Atoms | 24 |
| Complexity | 922.5815 |
Chemical Identifiers
| CAS Number | 344896-57-7 |
|---|---|
| SMILES | CSC1=NC2=CC=CC=C2N1CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide (CAS 344896-57-7), with molecular formula C16H14N4O3S and molecular weight 342.08 g/mol. IUPAC: 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide
Property Insights of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide
The XLogP value of 3.3051 indicates that 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide has 1 hydrogen bond donor(s) and 5 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 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide?
The CAS number of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide is 344896-57-7.
What is the molecular formula of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide?
The molecular formula of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide is C16H14N4O3S.
What is the molecular weight of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide?
The molecular weight of 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide is 342.08 g/mol.
Where can I buy 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide?
You can request a quote for 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-methylsulfanylbenzimidazol-1-yl)-N-(3-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.