![[1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate structure](/static/products/5191/519168-76-4.webp)
[1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate
TL;DR: [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate (CAS 519168-76-4) is a chemical compound with molecular formula C23H17ClN2O6 and molecular weight 452.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(3-chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate
Also Known As: [1-(3-chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate|1-(3-chlorophenyl)-1-oxopropan-2-yl 2-{[(4-nitrophenyl)carbonyl]amino}benzoate|[1-(3-chlorophenyl)-1-oxo-propan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate|1-(3-CHLOROPHENYL)-1-OXOPROPAN-2-YL 2-(4-NITROBENZAMIDO)BENZOATE
| Molecular Formula | C23H17ClN2O6 |
|---|---|
| Molecular Weight | 452.08 g/mol |
| LogP | 4.9287 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.0775 |
| Heavy Atoms | 32 |
| Complexity | 1193.1008 |
Chemical Identifiers
| CAS Number | 519168-76-4 |
|---|---|
| SMILES | CC(C(=O)C1=CC(=CC=C1)Cl)OC(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
[1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate (CAS 519168-76-4), with molecular formula C23H17ClN2O6 and molecular weight 452.08 g/mol. IUPAC: [1-(3-chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate.
Chemical Property Profile of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate
Property Insights of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate
The XLogP value of 4.9287 indicates that [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.61 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate. Following Lipinski's Rule of Five, [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate has 1 hydrogen bond donor(s) and 6 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 [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate?
The CAS number of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate is 519168-76-4.
What is the molecular formula of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate?
The molecular formula of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate is C23H17ClN2O6.
What is the molecular weight of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate?
The molecular weight of [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate is 452.08 g/mol.
Where can I buy [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate?
You can request a quote for [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for [1-(3-Chlorophenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.