![2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid structure](/static/products/512/512181-30-5.png)
2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid
TL;DR: 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid (CAS 512181-30-5) is a chemical compound with molecular formula C16H15NO3 and molecular weight 269.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methylphenyl)methylcarbamoyl]benzoic acid
Also Known As: 2-{[(2-methylbenzyl)amino]carbonyl}benzoic acid, 2-[(2-methylphenyl)methylcarbamoyl]benzoic acid, AQ-360/42595946
| Molecular Formula | C16H15NO3 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 2.62322 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.1052 |
| Heavy Atoms | 20 |
| Complexity | 649.6752 |
Chemical Identifiers
| CAS Number | 512181-30-5 |
|---|---|
| SMILES | CC1=CC=CC=C1CNC(=O)C2=CC=CC=C2C(=O)O |
Product Overview
2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid (CAS 512181-30-5), with molecular formula C16H15NO3 and molecular weight 269.11 g/mol. IUPAC: 2-[(2-methylphenyl)methylcarbamoyl]benzoic acid.
Chemical Property Profile of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid
Property Insights of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid
The XLogP value of 2.62322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid. Following Lipinski's Rule of Five, 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid has 2 hydrogen bond donor(s) and 2 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-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid?
The CAS number of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid is 512181-30-5.
What is the molecular formula of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid?
The molecular formula of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid is C16H15NO3.
What is the molecular weight of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid?
The molecular weight of 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid is 269.11 g/mol.
Where can I buy 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid?
You can request a quote for 2-{[(2-Methylbenzyl)amino]carbonyl}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-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(2-Methylbenzyl)amino]carbonyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.