4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid
TL;DR: 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid (CAS 181517-99-7) is a chemical compound with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetic acid
Also Known As: nchembio798_comp7, 2-(4-(3-(o-Tolyl)ureido)phenyl)acetic acid, [4-(3-o-Tolyl-ureido)-phenyl]-acetic acid, 4-o-tolylureidophenylacetic acid, 4-[3-(o-Tolyl)ureido]phenylacetic Acid
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 3.26612 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 650.8266 |
Chemical Identifiers
| CAS Number | 181517-99-7 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)O |
Product Overview
4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid (CAS 181517-99-7), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: 2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetic acid.
Chemical Property Profile of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid
Property Insights of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid
The XLogP value of 3.26612 indicates that 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid. Following Lipinski's Rule of Five, 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid has 3 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 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid?
The CAS number of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid is 181517-99-7.
What is the molecular formula of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid?
The molecular formula of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid is C16H16N2O3.
What is the molecular weight of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid?
The molecular weight of 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid is 284.12 g/mol.
Where can I buy 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid?
You can request a quote for 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((((2-Methylphenyl)amino)carbonyl)amino)benzeneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.