ChemDiv1_009579
TL;DR: ChemDiv1_009579 (CAS 495374-80-6) is a chemical compound with molecular formula C32H37NO9 and molecular weight 579.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate
Also Known As: ChemDiv1_009579, diethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-3,6-quinolinedicarboxylate, AN-919/40736719, diethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate, 3,6-DIETHYL 7-(2-METHOXYPHENYL)-2-METHYL-5-OXO-4-(3,4,5-TRIMETHOXYPHENYL)-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3,6-DICARBOXYLATE
| Molecular Formula | C32H37NO9 |
|---|---|
| Molecular Weight | 579.25 g/mol |
| LogP | 4.4349 |
| Topological Polar Surface Area | 118.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 579.2468 |
| Heavy Atoms | 42 |
| Complexity | 1416.205 |
Chemical Identifiers
| CAS Number | 495374-80-6 |
|---|---|
| SMILES | CCOC(=O)C1C(CC2=C(C1=O)C(C(=C(N2)C)C(=O)OCC)C3=CC(=C(C(=C3)OC)OC)OC)C4=CC=CC=C4OC |
Product Overview
ChemDiv1_009579 (CAS 495374-80-6), with molecular formula C32H37NO9 and molecular weight 579.25 g/mol. IUPAC: diethyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate.
Chemical Property Profile of ChemDiv1_009579
Property Insights of ChemDiv1_009579
The XLogP value of 4.4349 indicates that ChemDiv1_009579 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.62 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009579. Following Lipinski's Rule of Five, ChemDiv1_009579 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_009579?
The CAS number of ChemDiv1_009579 is 495374-80-6.
What is the molecular formula of ChemDiv1_009579?
The molecular formula of ChemDiv1_009579 is C32H37NO9.
What is the molecular weight of ChemDiv1_009579?
The molecular weight of ChemDiv1_009579 is 579.25 g/mol.
Where can I buy ChemDiv1_009579?
You can request a quote for ChemDiv1_009579 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009579?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009579 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.