Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester
TL;DR: Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester (CAS 19680-14-9) is a chemical compound with molecular formula C17H14ClNO4 and molecular weight 331.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-chlorophenyl)-2-oxoethyl] 2-benzamidoacetate
Also Known As: BAS 00381860, BIM-0023567.P001, 2-(4-chlorophenyl)-2-oxoethyl 2-benzamidoacetate, AB00088625-01, [2-(4-chlorophenyl)-2-oxoethyl] 2-benzamidoacetate
| Molecular Formula | C17H14ClNO4 |
|---|---|
| Molecular Weight | 331.06 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.06113 |
| Heavy Atoms | 23 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 19680-14-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | CBWCMTVYAVIGIG-UHFFFAOYSA-N |
Product Overview
Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester (CAS 19680-14-9), with molecular formula C17H14ClNO4 and molecular weight 331.06 g/mol. IUPAC: [2-(4-chlorophenyl)-2-oxoethyl] 2-benzamidoacetate.
Chemical Property Profile of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester
Property Insights of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester
The XLogP value of 3.2 indicates that Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester. Following Lipinski's Rule of Five, Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl 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 Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester?
The CAS number of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester is 19680-14-9.
What is the molecular formula of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester?
The molecular formula of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester is C17H14ClNO4.
What is the molecular weight of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester?
The molecular weight of Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester is 331.06 g/mol.
Where can I buy Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester?
You can request a quote for Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-benzoylamino-, 2-(4-chlorophenyl)-2-oxoethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.