![2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid structure](/static/products/3334/333433-91-3.webp)
2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid
TL;DR: 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid (CAS 333433-91-3) is a chemical compound with molecular formula C13H8N4O6 and molecular weight 316.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzoic acid
Also Known As: 2-hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid, 2-hydroxy-5-({4-nitro-2,1,3-benzoxadiazol-5-yl}amino)benzoic acid, 2-hydroxy-5-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzoic acid, 3-[(4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl)imino]-6-oxocyclohexa-1,4-diene-1-carboxylic acid
| Molecular Formula | C13H8N4O6 |
|---|---|
| Molecular Weight | 316.04 g/mol |
| LogP | 2.2784 |
| Topological Polar Surface Area | 151.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.04437 |
| Heavy Atoms | 23 |
| Complexity | 935.3595 |
Chemical Identifiers
| CAS Number | 333433-91-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC2=C(C3=NON=C3C=C2)[N+](=O)[O-])C(=O)O)O |
Product Overview
2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid (CAS 333433-91-3), with molecular formula C13H8N4O6 and molecular weight 316.04 g/mol. IUPAC: 2-hydroxy-5-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzoic acid.
Chemical Property Profile of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid
Property Insights of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid
The XLogP value of 2.2784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid. The TPSA of 151.62 Ų indicates high polarity, suggesting 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid has 3 hydrogen bond donor(s) and 8 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-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid?
The CAS number of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid is 333433-91-3.
What is the molecular formula of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid?
The molecular formula of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid is C13H8N4O6.
What is the molecular weight of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid?
The molecular weight of 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid is 316.04 g/mol.
Where can I buy 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid?
You can request a quote for 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-5-((4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.