2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate
TL;DR: 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate (CAS 355433-95-3) is a chemical compound with molecular formula C19H13ClN2O5 and molecular weight 384.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-methylquinoline-4-carboxylate
Also Known As: 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate, [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-methylquinoline-4-carboxylate
| Molecular Formula | C19H13ClN2O5 |
|---|---|
| Molecular Weight | 384.05 g/mol |
| LogP | 4.14452 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.0513 |
| Heavy Atoms | 27 |
| Complexity | 1080.883 |
Chemical Identifiers
| CAS Number | 355433-95-3 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-] |
Product Overview
2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate (CAS 355433-95-3), with molecular formula C19H13ClN2O5 and molecular weight 384.05 g/mol. IUPAC: [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2-methylquinoline-4-carboxylate.
Chemical Property Profile of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate
Property Insights of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate
The XLogP value of 4.14452 indicates that 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-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-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate. Following Lipinski's Rule of Five, 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-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-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate?
The CAS number of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate is 355433-95-3.
What is the molecular formula of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate?
The molecular formula of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate is C19H13ClN2O5.
What is the molecular weight of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate?
The molecular weight of 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate is 384.05 g/mol.
Where can I buy 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate?
You can request a quote for 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-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-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-3-nitrophenyl)-2-oxoethyl 2-methylquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.