ChemDiv1_008482
TL;DR: ChemDiv1_008482 (CAS 420095-83-6) is a chemical compound with molecular formula C27H27Cl2NO6 and molecular weight 531.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_008482, 2-methoxyethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-methoxyethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-2-met hyl-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carboxylate, 2-methoxyethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C27H27Cl2NO6 |
|---|---|
| Molecular Weight | 531.12 g/mol |
| LogP | 5.2588 |
| Topological Polar Surface Area | 94.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 531.1215 |
| Heavy Atoms | 36 |
| Complexity | 1251.6554 |
Chemical Identifiers
| CAS Number | 420095-83-6 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=C(C(=C4)Cl)O)OC)C(=O)OCCOC |
Product Overview
ChemDiv1_008482 (CAS 420095-83-6), with molecular formula C27H27Cl2NO6 and molecular weight 531.12 g/mol. IUPAC: 2-methoxyethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_008482
Property Insights of ChemDiv1_008482
The XLogP value of 5.2588 indicates that ChemDiv1_008482 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.09 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008482. Following Lipinski's Rule of Five, ChemDiv1_008482 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_008482?
The CAS number of ChemDiv1_008482 is 420095-83-6.
What is the molecular formula of ChemDiv1_008482?
The molecular formula of ChemDiv1_008482 is C27H27Cl2NO6.
What is the molecular weight of ChemDiv1_008482?
The molecular weight of ChemDiv1_008482 is 531.12 g/mol.
Where can I buy ChemDiv1_008482?
You can request a quote for ChemDiv1_008482 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008482?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008482 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.