![4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid structure](/static/products/4285/428503-96-2.webp)
4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid
TL;DR: 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid (CAS 428503-96-2) is a chemical compound with molecular formula C16H14ClNO3 and molecular weight 303.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-(3-phenylpropanoylamino)benzoic acid
Also Known As: 4-chloro-2-[(3-phenylpropanoyl)amino]benzoic acid, 4-chloro-2-(3-phenylpropanoylamino)benzoic acid, 4-Chloro-2-(3-phenyl-propionylamino)-benzoic acid, A2894/0121891, 4-CHLORO-2-(3-PHENYLPROPANAMIDO)BENZOIC ACID
| Molecular Formula | C16H14ClNO3 |
|---|---|
| Molecular Weight | 303.07 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.06622 |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 428503-96-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
| InChIKey | VLMYPKZXHPYVDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid (CAS 428503-96-2), with molecular formula C16H14ClNO3 and molecular weight 303.07 g/mol. IUPAC: 4-chloro-2-(3-phenylpropanoylamino)benzoic acid.
Chemical Property Profile of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid
Property Insights of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid
The XLogP value of 3.7 indicates that 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid has 2 hydrogen bond donor(s) and 3 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-2-[(3-phenylpropanoyl)amino]benzoic acid?
The CAS number of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid is 428503-96-2.
What is the molecular formula of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid?
The molecular formula of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid is C16H14ClNO3.
What is the molecular weight of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid?
The molecular weight of 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid is 303.07 g/mol.
Where can I buy 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid?
You can request a quote for 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic 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-2-[(3-phenylpropanoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-[(3-phenylpropanoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.