Ethyl 4-(4-aminobenzamido)benzoate
TL;DR: Ethyl 4-(4-aminobenzamido)benzoate (CAS 63069-46-5) 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.
ethyl 4-[(4-aminobenzoyl)amino]benzoate
Also Known As: ethyl 4-[(4-aminobenzoyl)amino]benzoate, ETHYL 4-(4-AMINOBENZAMIDO)BENZOATE, ethyl 4-<(4'-aminobenzoyl)amino>benzoate, ethyl 4-[(4-aminophenyl)carbonylamino]benzoate, 4-(4-Amino-benzoylamino)-benzoic acid ethyl ester
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 63069-46-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N |
| InChIKey | BAYLXVNHSCZHNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4-(4-aminobenzamido)benzoate (CAS 63069-46-5), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: ethyl 4-[(4-aminobenzoyl)amino]benzoate.
Chemical Property Profile of Ethyl 4-(4-aminobenzamido)benzoate
Property Insights of Ethyl 4-(4-aminobenzamido)benzoate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(4-aminobenzamido)benzoate. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(4-aminobenzamido)benzoate. Following Lipinski's Rule of Five, Ethyl 4-(4-aminobenzamido)benzoate has 2 hydrogen bond donor(s) and 4 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-(4-aminobenzamido)benzoate?
The CAS number of Ethyl 4-(4-aminobenzamido)benzoate is 63069-46-5.
What is the molecular formula of Ethyl 4-(4-aminobenzamido)benzoate?
The molecular formula of Ethyl 4-(4-aminobenzamido)benzoate is C16H16N2O3.
What is the molecular weight of Ethyl 4-(4-aminobenzamido)benzoate?
The molecular weight of Ethyl 4-(4-aminobenzamido)benzoate is 284.12 g/mol.
Where can I buy Ethyl 4-(4-aminobenzamido)benzoate?
You can request a quote for Ethyl 4-(4-aminobenzamido)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-(4-aminobenzamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(4-aminobenzamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.