Benzimidazol-1-yl-(2-nitrophenyl)methanone
TL;DR: Benzimidazol-1-yl-(2-nitrophenyl)methanone (CAS 326901-35-3) is a chemical compound with molecular formula C14H9N3O3 and molecular weight 267.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzimidazol-1-yl-(2-nitrophenyl)methanone
Also Known As: benzimidazolyl 2-nitrophenyl ketone, BAS 00626590, benzimidazol-1-yl-(2-nitrophenyl)methanone, 1H-benzimidazol-1-yl(2-nitrophenyl)methanone, Benzoimidazol-1-yl-(2-nitro-phenyl)-methanone
| Molecular Formula | C14H9N3O3 |
|---|---|
| Molecular Weight | 267.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.0644 |
| Heavy Atoms | 20 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 326901-35-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)N2C=NC3=CC=CC=C32)[N+](=O)[O-] |
| InChIKey | GKIPBWSGKXVORT-UHFFFAOYSA-N |
Product Overview
Benzimidazol-1-yl-(2-nitrophenyl)methanone (CAS 326901-35-3), with molecular formula C14H9N3O3 and molecular weight 267.06 g/mol. IUPAC: benzimidazol-1-yl-(2-nitrophenyl)methanone.
Chemical Property Profile of Benzimidazol-1-yl-(2-nitrophenyl)methanone
Property Insights of Benzimidazol-1-yl-(2-nitrophenyl)methanone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazol-1-yl-(2-nitrophenyl)methanone. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazol-1-yl-(2-nitrophenyl)methanone. Following Lipinski's Rule of Five, Benzimidazol-1-yl-(2-nitrophenyl)methanone has 0 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 Benzimidazol-1-yl-(2-nitrophenyl)methanone?
The CAS number of Benzimidazol-1-yl-(2-nitrophenyl)methanone is 326901-35-3.
What is the molecular formula of Benzimidazol-1-yl-(2-nitrophenyl)methanone?
The molecular formula of Benzimidazol-1-yl-(2-nitrophenyl)methanone is C14H9N3O3.
What is the molecular weight of Benzimidazol-1-yl-(2-nitrophenyl)methanone?
The molecular weight of Benzimidazol-1-yl-(2-nitrophenyl)methanone is 267.06 g/mol.
Where can I buy Benzimidazol-1-yl-(2-nitrophenyl)methanone?
You can request a quote for Benzimidazol-1-yl-(2-nitrophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazol-1-yl-(2-nitrophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazol-1-yl-(2-nitrophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.