2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate
TL;DR: 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate (CAS 354533-76-9) is a chemical compound with molecular formula C24H16N2O5 and molecular weight 412.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-nitrophenyl)-2-oxoethyl] 2-phenylquinoline-4-carboxylate
Also Known As: 2-(3-nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate, [2-(3-nitrophenyl)-2-oxoethyl] 2-phenylquinoline-4-carboxylate, 2-(3-NITROPHENYL)-2-OXOETHYL 2-PHENYL-4-QUINOLINECARBOXYLATE
| Molecular Formula | C24H16N2O5 |
|---|---|
| Molecular Weight | 412.11 g/mol |
| LogP | 4.8497 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.10593 |
| Heavy Atoms | 31 |
| Complexity | 1301.8748 |
Chemical Identifiers
| CAS Number | 354533-76-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate (CAS 354533-76-9), with molecular formula C24H16N2O5 and molecular weight 412.11 g/mol. IUPAC: [2-(3-nitrophenyl)-2-oxoethyl] 2-phenylquinoline-4-carboxylate.
Chemical Property Profile of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate
Property Insights of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate
The XLogP value of 4.8497 indicates that 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate. Following Lipinski's Rule of Five, 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate has 0 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 2-phenylquinoline-4-carboxylate?
The CAS number of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate is 354533-76-9.
What is the molecular formula of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate?
The molecular formula of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate is C24H16N2O5.
What is the molecular weight of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate?
The molecular weight of 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate is 412.11 g/mol.
Where can I buy 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate?
You can request a quote for 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate 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 2-phenylquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Nitrophenyl)-2-oxoethyl 2-phenylquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.