1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one
TL;DR: 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one (CAS 310447-13-3) is a chemical compound with molecular formula C13H11N3O4 and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-2-(3-nitrophenyl)-6,7-dihydro-5H-benzimidazol-4-one
Also Known As: AB00081428-01, 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one, 1-hydroxy-2-(3-nitrophenyl)-6,7-dihydro-5H-benzimidazol-4-one, 1-hydroxy-2-(3-nitrophenyl)-6,7-dihydro-1H-benzo[d]imidazol-4(5H)-one
| Molecular Formula | C13H11N3O4 |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | 2.2146 |
| Topological Polar Surface Area | 98.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.07495 |
| Heavy Atoms | 20 |
| Complexity | 720.4015 |
Chemical Identifiers
| CAS Number | 310447-13-3 |
|---|---|
| SMILES | C1CC2=C(C(=O)C1)N=C(N2O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one (CAS 310447-13-3), with molecular formula C13H11N3O4 and molecular weight 273.07 g/mol. IUPAC: 1-hydroxy-2-(3-nitrophenyl)-6,7-dihydro-5H-benzimidazol-4-one.
Chemical Property Profile of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one
Property Insights of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one
The XLogP value of 2.2146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one. The TPSA of 98.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one. Following Lipinski's Rule of Five, 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one 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 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one?
The CAS number of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one is 310447-13-3.
What is the molecular formula of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one?
The molecular formula of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one is C13H11N3O4.
What is the molecular weight of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one?
The molecular weight of 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one is 273.07 g/mol.
Where can I buy 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one?
You can request a quote for 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1-hydroxy-2-(3-nitrophenyl)-1,5,6,7-tetrahydro-4H-benzimidazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.