(4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid
TL;DR: (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid (CAS 725253-11-2) is a chemical compound with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-2-(3,4-dimethylanilino)acetic acid
Also Known As: (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid, 2-(4-chlorophenyl)-2-(3,4-dimethylanilino)acetic acid, 2-(4-Chlorophenyl)-2-((3,4-dimethylphenyl)amino)acetic acid, 2-(4-Chlorophenyl)-2-((3,4-dimethylphenyl)amino)aceticacid, 2-(4-chlorophenyl)-2-[(3,4-dimethylphenyl)amino]acetic Acid
| Molecular Formula | C16H16ClNO2 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 4.19464 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.08694 |
| Heavy Atoms | 20 |
| Complexity | 622.874 |
Chemical Identifiers
| CAS Number | 725253-11-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(C2=CC=C(C=C2)Cl)C(=O)O)C |
Product Overview
(4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid (CAS 725253-11-2), with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol. IUPAC: 2-(4-chlorophenyl)-2-(3,4-dimethylanilino)acetic acid.
Chemical Property Profile of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid
Property Insights of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid
The XLogP value of 4.19464 indicates that (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic 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 (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid?
The CAS number of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid is 725253-11-2.
What is the molecular formula of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid?
The molecular formula of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid is C16H16ClNO2.
What is the molecular weight of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid?
The molecular weight of (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid is 289.09 g/mol.
Where can I buy (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid?
You can request a quote for (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-Chloro-phenyl)-(3,4-dimethyl-phenylamino)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.