![[2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate structure](/static/products/3554/355411-63-1.webp)
[2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate
TL;DR: [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate (CAS 355411-63-1) is a chemical compound with molecular formula C20H15ClN2O5 and molecular weight 398.07 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] 2,6-dimethylquinoline-4-carboxylate
Also Known As: [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate, 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,6-dimethyl-4-quinolinecarboxylate, 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,6-dimethylquinoline-4-carboxylate, [2-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2,6-dimethylquinoline-4-carboxylate, 2,6-dimethyl-4-quinolinecarboxylic acid [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] ester
| Molecular Formula | C20H15ClN2O5 |
|---|---|
| Molecular Weight | 398.07 g/mol |
| LogP | 4.45294 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.06696 |
| Heavy Atoms | 28 |
| Complexity | 1127.0243 |
Chemical Identifiers
| CAS Number | 355411-63-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C(N=C2C=C1)C)C(=O)OCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-] |
Product Overview
[2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate (CAS 355411-63-1), with molecular formula C20H15ClN2O5 and molecular weight 398.07 g/mol. IUPAC: [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate.
Chemical Property Profile of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate
Property Insights of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate
The XLogP value of 4.45294 indicates that [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-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] 2,6-dimethylquinoline-4-carboxylate. Following Lipinski's Rule of Five, [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-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] 2,6-dimethylquinoline-4-carboxylate?
The CAS number of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate is 355411-63-1.
What is the molecular formula of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate?
The molecular formula of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate is C20H15ClN2O5.
What is the molecular weight of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate?
The molecular weight of [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate is 398.07 g/mol.
Where can I buy [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate?
You can request a quote for [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-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] 2,6-dimethylquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Chloro-3-nitrophenyl)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.