3-Nitro-2-(phenylcarbamoyl)benzoic acid
TL;DR: 3-Nitro-2-(phenylcarbamoyl)benzoic acid (CAS 6745-01-3) is a chemical compound with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-2-(phenylcarbamoyl)benzoic acid
Also Known As: 3-nitro-2-(phenylcarbamoyl)benzoic acid, 3-nitro-2-(N-phenylcarbamoyl)benzoic acid
| Molecular Formula | C14H10N2O5 |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 2.5453 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.05896 |
| Heavy Atoms | 21 |
| Complexity | 680.30927 |
Chemical Identifiers
| CAS Number | 6745-01-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C2=C(C=CC=C2[N+](=O)[O-])C(=O)O |
Product Overview
3-Nitro-2-(phenylcarbamoyl)benzoic acid (CAS 6745-01-3), with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol. IUPAC: 3-nitro-2-(phenylcarbamoyl)benzoic acid.
Chemical Property Profile of 3-Nitro-2-(phenylcarbamoyl)benzoic acid
Property Insights of 3-Nitro-2-(phenylcarbamoyl)benzoic acid
The XLogP value of 2.5453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-2-(phenylcarbamoyl)benzoic acid. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-2-(phenylcarbamoyl)benzoic acid. Following Lipinski's Rule of Five, 3-Nitro-2-(phenylcarbamoyl)benzoic acid has 2 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 3-Nitro-2-(phenylcarbamoyl)benzoic acid?
The CAS number of 3-Nitro-2-(phenylcarbamoyl)benzoic acid is 6745-01-3.
What is the molecular formula of 3-Nitro-2-(phenylcarbamoyl)benzoic acid?
The molecular formula of 3-Nitro-2-(phenylcarbamoyl)benzoic acid is C14H10N2O5.
What is the molecular weight of 3-Nitro-2-(phenylcarbamoyl)benzoic acid?
The molecular weight of 3-Nitro-2-(phenylcarbamoyl)benzoic acid is 286.06 g/mol.
Where can I buy 3-Nitro-2-(phenylcarbamoyl)benzoic acid?
You can request a quote for 3-Nitro-2-(phenylcarbamoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-2-(phenylcarbamoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-2-(phenylcarbamoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.