1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate
TL;DR: 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate (CAS 667432-29-3) is a chemical compound with molecular formula C25H22ClNO4 and molecular weight 435.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-chlorophenyl)-2-oxo-2-phenylethyl] 3-(2-methylpropanoylamino)benzoate
Also Known As: 1-(4-chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate, 1-(4-chlorophenyl)-2-oxo-2-phenylethyl 3-isobutyramidobenzoate, [1-(4-chlorophenyl)-2-oxo-2-phenylethyl] 3-(2-methylpropanoylamino)benzoate, 1-(4-chlorophenyl)-2-oxo-2-phenylethyl 3-[(2-methylpropanoyl)amino]benzoate
| Molecular Formula | C25H22ClNO4 |
|---|---|
| Molecular Weight | 435.12 g/mol |
| LogP | 5.7155 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 435.12375 |
| Heavy Atoms | 31 |
| Complexity | 1078.1908 |
Chemical Identifiers
| CAS Number | 667432-29-3 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC=CC(=C1)C(=O)OC(C2=CC=C(C=C2)Cl)C(=O)C3=CC=CC=C3 |
Product Overview
1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate (CAS 667432-29-3), with molecular formula C25H22ClNO4 and molecular weight 435.12 g/mol. IUPAC: [1-(4-chlorophenyl)-2-oxo-2-phenylethyl] 3-(2-methylpropanoylamino)benzoate.
Chemical Property Profile of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate
Property Insights of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate
The XLogP value of 5.7155 indicates that 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate?
The CAS number of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate is 667432-29-3.
What is the molecular formula of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate?
The molecular formula of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate is C25H22ClNO4.
What is the molecular weight of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate?
The molecular weight of 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate is 435.12 g/mol.
Where can I buy 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate?
You can request a quote for 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-2-oxo-2-phenylethyl 3-(isobutyrylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.