ChemDiv1_002304
TL;DR: ChemDiv1_002304 (CAS 329072-11-9) is a chemical compound with molecular formula C26H25ClN2O6 and molecular weight 496.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 7-(4-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_002304, AB00094409-01, 2-methoxyethyl 7-(4-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-methoxyethyl 7-(4-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, 2-methoxyethyl 7-(4-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,6,7,8-p entahydroquinoline-3-carboxylate
| Molecular Formula | C26H25ClN2O6 |
|---|---|
| Molecular Weight | 496.14 g/mol |
| LogP | 4.7994 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.1401 |
| Heavy Atoms | 35 |
| Complexity | 1217.4081 |
Chemical Identifiers
| CAS Number | 329072-11-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OCCOC |
Product Overview
ChemDiv1_002304 (CAS 329072-11-9), with molecular formula C26H25ClN2O6 and molecular weight 496.14 g/mol. IUPAC: 2-methoxyethyl 7-(4-chlorophenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_002304
Property Insights of ChemDiv1_002304
The XLogP value of 4.7994 indicates that ChemDiv1_002304 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002304. Following Lipinski's Rule of Five, ChemDiv1_002304 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_002304?
The CAS number of ChemDiv1_002304 is 329072-11-9.
What is the molecular formula of ChemDiv1_002304?
The molecular formula of ChemDiv1_002304 is C26H25ClN2O6.
What is the molecular weight of ChemDiv1_002304?
The molecular weight of ChemDiv1_002304 is 496.14 g/mol.
Where can I buy ChemDiv1_002304?
You can request a quote for ChemDiv1_002304 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002304?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002304 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.