ChemDiv1_002747
TL;DR: ChemDiv1_002747 (CAS 5727-25-3) is a chemical compound with molecular formula C29H33NO6 and molecular weight 491.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxyethyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_002747, AB00094784-01, 2-ethoxyethyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-ethoxyethyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, 2-ethoxyethyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C29H33NO6 |
|---|---|
| Molecular Weight | 491.23 g/mol |
| LogP | 4.6451 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 491.23077 |
| Heavy Atoms | 36 |
| Complexity | 1183.5055 |
Chemical Identifiers
| CAS Number | 5727-25-3 |
|---|---|
| SMILES | CCOCCOC(=O)C1=C(NC2=C(C1C3=C(C=CC(=C3)OC)OC)C(=O)CC(C2)C4=CC=CC=C4)C |
Product Overview
ChemDiv1_002747 (CAS 5727-25-3), with molecular formula C29H33NO6 and molecular weight 491.23 g/mol. IUPAC: 2-ethoxyethyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_002747
Property Insights of ChemDiv1_002747
The XLogP value of 4.6451 indicates that ChemDiv1_002747 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002747. Following Lipinski's Rule of Five, ChemDiv1_002747 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_002747?
The CAS number of ChemDiv1_002747 is 5727-25-3.
What is the molecular formula of ChemDiv1_002747?
The molecular formula of ChemDiv1_002747 is C29H33NO6.
What is the molecular weight of ChemDiv1_002747?
The molecular weight of ChemDiv1_002747 is 491.23 g/mol.
Where can I buy ChemDiv1_002747?
You can request a quote for ChemDiv1_002747 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002747?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002747 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.