![2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate structure](/static/products/4333/433306-68-4.webp)
2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate
TL;DR: 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate (CAS 433306-68-4) is a chemical compound with molecular formula C22H15FN2O6 and molecular weight 422.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-fluorophenyl)-2-oxoethyl] 3-[(4-nitrobenzoyl)amino]benzoate
Also Known As: [2-(4-fluorophenyl)-2-oxoethyl] 3-[(4-nitrobenzoyl)amino]benzoate, 2-(4-FLUOROPHENYL)-2-OXOETHYL 3-(4-NITROBENZAMIDO)BENZOATE, [2-(4-fluorophenyl)-2-oxo-ethyl] 3-[(4-nitrobenzoyl)amino]benzoate, 2-(4-fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate
| Molecular Formula | C22H15FN2O6 |
|---|---|
| Molecular Weight | 422.09 g/mol |
| LogP | 4.0259 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.0914 |
| Heavy Atoms | 31 |
| Complexity | 1143.4225 |
Chemical Identifiers
| CAS Number | 433306-68-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)C3=CC=C(C=C3)F |
Product Overview
2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate (CAS 433306-68-4), with molecular formula C22H15FN2O6 and molecular weight 422.09 g/mol. IUPAC: [2-(4-fluorophenyl)-2-oxoethyl] 3-[(4-nitrobenzoyl)amino]benzoate.
Chemical Property Profile of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate
Property Insights of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate
The XLogP value of 4.0259 indicates that 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]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-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]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-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate?
The CAS number of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate is 433306-68-4.
What is the molecular formula of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate?
The molecular formula of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate is C22H15FN2O6.
What is the molecular weight of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate?
The molecular weight of 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate is 422.09 g/mol.
Where can I buy 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate?
You can request a quote for 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]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-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorophenyl)-2-oxoethyl 3-{[(4-nitrophenyl)carbonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.