Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate
TL;DR: Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate (CAS 199180-10-4) is a chemical compound with molecular formula C16H13Cl2NO3 and molecular weight 337.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate
Also Known As: Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate, Benzoic acid, 4-[(2,4-dichlorobenzoyl)amino]-, ethyl ester, BIM-0016981.P001, ETHYL 4-(2,4-DICHLOROBENZAMIDO)BENZOATE, ethyl 4-[(2,4-dichlorobenzene)amido]benzoate
| Molecular Formula | C16H13Cl2NO3 |
|---|---|
| Molecular Weight | 337.03 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.02725 |
| Heavy Atoms | 22 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 199180-10-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl |
| InChIKey | IXGUADNRLBSRDZ-UHFFFAOYSA-N |
Product Overview
Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate (CAS 199180-10-4), with molecular formula C16H13Cl2NO3 and molecular weight 337.03 g/mol. IUPAC: ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate.
Chemical Property Profile of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate
Property Insights of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate
The XLogP value of 4.2 indicates that Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate has 1 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 Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate?
The CAS number of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate is 199180-10-4.
What is the molecular formula of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate?
The molecular formula of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate is C16H13Cl2NO3.
What is the molecular weight of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate?
The molecular weight of Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate is 337.03 g/mol.
Where can I buy Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate?
You can request a quote for Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(2,4-dichlorobenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.