Anthranilic acid, N-nicotinoyl-
TL;DR: Anthranilic acid, N-nicotinoyl- (CAS 85684-61-3) is a chemical compound with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridine-3-carbonylamino)benzoic acid
Also Known As: 2-(Nicotinamido)benzoic acid, o-Nicotinamidobenzoic acid, 2-[(Pyridine-3-carbonyl)-amino]-benzoic acid, Anthranilic acid, N-nicotinoyl-, N-Nicotinoylanthranilic acid
| Molecular Formula | C13H10N2O3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.06914 |
| Heavy Atoms | 18 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 85684-61-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CN=CC=C2 |
| InChIKey | JYBNOUMWGUMFBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Anthranilic acid, N-nicotinoyl- (CAS 85684-61-3), with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol. IUPAC: 2-(pyridine-3-carbonylamino)benzoic acid.
Chemical Property Profile of Anthranilic acid, N-nicotinoyl-
Property Insights of Anthranilic acid, N-nicotinoyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anthranilic acid, N-nicotinoyl-. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Anthranilic acid, N-nicotinoyl-. Following Lipinski's Rule of Five, Anthranilic acid, N-nicotinoyl- 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 Anthranilic acid, N-nicotinoyl-?
The CAS number of Anthranilic acid, N-nicotinoyl- is 85684-61-3.
What is the molecular formula of Anthranilic acid, N-nicotinoyl-?
The molecular formula of Anthranilic acid, N-nicotinoyl- is C13H10N2O3.
What is the molecular weight of Anthranilic acid, N-nicotinoyl-?
The molecular weight of Anthranilic acid, N-nicotinoyl- is 242.07 g/mol.
Where can I buy Anthranilic acid, N-nicotinoyl-?
You can request a quote for Anthranilic acid, N-nicotinoyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthranilic acid, N-nicotinoyl-?
Yes, KEHONG BIO provides custom synthesis services for Anthranilic acid, N-nicotinoyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.