![2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate structure](/static/products/3133/313392-06-2.webp)
2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate
TL;DR: 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate (CAS 313392-06-2) is a chemical compound with molecular formula C23H18N2O6 and molecular weight 418.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-nitrophenyl)-2-oxoethyl] 4-[(2-phenylacetyl)amino]benzoate
Also Known As: 2-(3-nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate, [2-(3-nitrophenyl)-2-oxoethyl] 4-[(2-phenylacetyl)amino]benzoate, 2-(3-NITROPHENYL)-2-OXOETHYL 4-(2-PHENYLACETAMIDO)BENZOATE, 2-(3-nitrophenyl)-2-oxoethyl 4-(2-phenylacetylamino)benzoate, 2-{3-nitrophenyl}-2-oxoethyl 4-[(phenylacetyl)amino]benzoate
| Molecular Formula | C23H18N2O6 |
|---|---|
| Molecular Weight | 418.12 g/mol |
| LogP | 3.8157 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.1165 |
| Heavy Atoms | 31 |
| Complexity | 1110.4253 |
Chemical Identifiers
| CAS Number | 313392-06-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate (CAS 313392-06-2), with molecular formula C23H18N2O6 and molecular weight 418.12 g/mol. IUPAC: [2-(3-nitrophenyl)-2-oxoethyl] 4-[(2-phenylacetyl)amino]benzoate.
Chemical Property Profile of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate
Property Insights of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate
The XLogP value of 3.8157 indicates that 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)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 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate. Following Lipinski's Rule of Five, 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)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 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate?
The CAS number of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate is 313392-06-2.
What is the molecular formula of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate?
The molecular formula of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate is C23H18N2O6.
What is the molecular weight of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate?
The molecular weight of 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate is 418.12 g/mol.
Where can I buy 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate?
You can request a quote for 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Nitrophenyl)-2-oxoethyl 4-[(phenylacetyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.