2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol
TL;DR: 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol (CAS 400075-28-7) is a chemical compound with molecular formula C14H11N3O4 and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-2-(3-methoxyphenyl)-6-nitrobenzimidazole
Also Known As: 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol, 11F-359S, 1-hydroxy-2-(3-methoxyphenyl)-6-nitrobenzimidazole, 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzodiazol-1-ol, 2-(3-Methoxyphenyl)-6-nitro-1H-benzimidazol-1-ol
| Molecular Formula | C14H11N3O4 |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 2.8574 |
| Topological Polar Surface Area | 90.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.07495 |
| Heavy Atoms | 21 |
| Complexity | 841.35144 |
Chemical Identifiers
| CAS Number | 400075-28-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-] |
Product Overview
2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol (CAS 400075-28-7), with molecular formula C14H11N3O4 and molecular weight 285.07 g/mol. IUPAC: 1-hydroxy-2-(3-methoxyphenyl)-6-nitrobenzimidazole.
Chemical Property Profile of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol
Property Insights of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol
The XLogP value of 2.8574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol. The TPSA of 90.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol. Following Lipinski's Rule of Five, 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol 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-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol?
The CAS number of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol is 400075-28-7.
What is the molecular formula of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol?
The molecular formula of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol is C14H11N3O4.
What is the molecular weight of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol?
The molecular weight of 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol is 285.07 g/mol.
Where can I buy 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol?
You can request a quote for 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-methoxyphenyl)-6-nitro-1H-1,3-benzimidazol-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.