![2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate structure](/static/products/765/765925-76-6.png)
2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate
TL;DR: 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate (CAS 765925-76-6) is a chemical compound with molecular formula C15H11FN2O5 and molecular weight 318.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-nitroanilino)-2-oxoethyl] 4-fluorobenzoate
Also Known As: 2-[(2-nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate, [2-(2-nitroanilino)-2-oxoethyl] 4-fluorobenzoate, 2-((2-nitrophenyl)amino)-2-oxoethyl 4-fluorobenzoate
| Molecular Formula | C15H11FN2O5 |
|---|---|
| Molecular Weight | 318.07 g/mol |
| LogP | 2.5294 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.0652 |
| Heavy Atoms | 23 |
| Complexity | 745.7874 |
Chemical Identifiers
| CAS Number | 765925-76-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)F)[N+](=O)[O-] |
Product Overview
2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate (CAS 765925-76-6), with molecular formula C15H11FN2O5 and molecular weight 318.07 g/mol. IUPAC: [2-(2-nitroanilino)-2-oxoethyl] 4-fluorobenzoate.
Chemical Property Profile of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate
Property Insights of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate
The XLogP value of 2.5294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate. Following Lipinski's Rule of Five, 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate has 1 hydrogen bond donor(s) and 5 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-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate?
The CAS number of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate is 765925-76-6.
What is the molecular formula of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate?
The molecular formula of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate is C15H11FN2O5.
What is the molecular weight of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate?
The molecular weight of 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate is 318.07 g/mol.
Where can I buy 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate?
You can request a quote for 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Nitrophenyl)amino]-2-oxoethyl 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.