2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester
TL;DR: 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester (CAS 130882-58-5) is a chemical compound with molecular formula C21H17NO3 and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(4-phenylphenyl)ethyl] 2-aminobenzoate
Also Known As: 2-amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester, p-phenylphenacyl 2-aminobenzoate, [2-oxo-2-(4-phenylphenyl)ethyl] 2-aminobenzoate, 2-oxo-2-(4-phenylphenyl)ethyl 2-aminobenzoate, 2-([1,1'-Biphenyl]-4-yl)-2-oxoethyl 2-aminobenzoate
| Molecular Formula | C21H17NO3 |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.12085 |
| Heavy Atoms | 25 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 130882-58-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC=CC=C3N |
| InChIKey | WRDRNNKQEWQAHW-UHFFFAOYSA-N |
Product Overview
2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester (CAS 130882-58-5), with molecular formula C21H17NO3 and molecular weight 331.12 g/mol. IUPAC: [2-oxo-2-(4-phenylphenyl)ethyl] 2-aminobenzoate.
Chemical Property Profile of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester
Property Insights of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester
The XLogP value of 4.7 indicates that 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester. Following Lipinski's Rule of Five, 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester has 1 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 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester?
The CAS number of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester is 130882-58-5.
What is the molecular formula of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester?
The molecular formula of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester is C21H17NO3.
What is the molecular weight of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester?
The molecular weight of 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester is 331.12 g/mol.
Where can I buy 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester?
You can request a quote for 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-benzoic acid 2-biphenyl-4-yl-2-oxo-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.