![[2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate structure](/static/products/3554/355431-73-1.webp)
[2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate
TL;DR: [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate (CAS 355431-73-1) is a chemical compound with molecular formula C20H19FN2O6 and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate
Also Known As: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate, 2-(4-METHYL-3-NITROPHENYL)-2-OXOETHYL 4-[(4-FLUOROPHENYL)CARBAMOYL]BUTANOATE, 2-(4-methyl-3-nitrophenyl)-2-oxoethyl 5-((4-fluorophenyl)amino)-5-oxopentanoate, 2-(4-methyl-3-nitrophenyl)-2-oxoethyl 5-[(4-fluorophenyl)amino]-5-oxopentanoate
| Molecular Formula | C20H19FN2O6 |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 3.57722 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 402.1227 |
| Heavy Atoms | 29 |
| Complexity | 927.0687 |
Chemical Identifiers
| CAS Number | 355431-73-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)F)[N+](=O)[O-] |
Product Overview
[2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate (CAS 355431-73-1), with molecular formula C20H19FN2O6 and molecular weight 402.12 g/mol. IUPAC: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate.
Chemical Property Profile of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate
Property Insights of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate
The XLogP value of 3.57722 indicates that [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate 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-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate. Following Lipinski's Rule of Five, [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate 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-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate?
The CAS number of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate is 355431-73-1.
What is the molecular formula of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate?
The molecular formula of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate is C20H19FN2O6.
What is the molecular weight of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate?
The molecular weight of [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate is 402.12 g/mol.
Where can I buy [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate?
You can request a quote for [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.