1-Phenylbenzimidazole deriv. 82
TL;DR: 1-Phenylbenzimidazole deriv. 82 (CAS 220495-79-4) is a chemical compound with molecular formula C13H9N3O2 and molecular weight 239.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-1-phenylbenzimidazole
Also Known As: 1-Phenylbenzimidazole deriv. 82, 6-nitro-1-phenylbenzimidazole, 6-Nitro-1-phenyl-1H-benzimidazole, 6-nitro-1-phenyl-1H-1,3-benzodiazole
| Molecular Formula | C13H9N3O2 |
|---|---|
| Molecular Weight | 239.07 g/mol |
| LogP | 2.9337 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.06947 |
| Heavy Atoms | 18 |
| Complexity | 719.4394 |
Chemical Identifiers
| CAS Number | 220495-79-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=NC3=C2C=C(C=C3)[N+](=O)[O-] |
Product Overview
1-Phenylbenzimidazole deriv. 82 (CAS 220495-79-4), with molecular formula C13H9N3O2 and molecular weight 239.07 g/mol. IUPAC: 6-nitro-1-phenylbenzimidazole.
Chemical Property Profile of 1-Phenylbenzimidazole deriv. 82
Property Insights of 1-Phenylbenzimidazole deriv. 82
The XLogP value of 2.9337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenylbenzimidazole deriv. 82. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenylbenzimidazole deriv. 82. Following Lipinski's Rule of Five, 1-Phenylbenzimidazole deriv. 82 has 0 hydrogen bond donor(s) and 3 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-Phenylbenzimidazole deriv. 82?
The CAS number of 1-Phenylbenzimidazole deriv. 82 is 220495-79-4.
What is the molecular formula of 1-Phenylbenzimidazole deriv. 82?
The molecular formula of 1-Phenylbenzimidazole deriv. 82 is C13H9N3O2.
What is the molecular weight of 1-Phenylbenzimidazole deriv. 82?
The molecular weight of 1-Phenylbenzimidazole deriv. 82 is 239.07 g/mol.
Where can I buy 1-Phenylbenzimidazole deriv. 82?
You can request a quote for 1-Phenylbenzimidazole deriv. 82 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenylbenzimidazole deriv. 82?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenylbenzimidazole deriv. 82 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.