ChemDiv1_006602
TL;DR: ChemDiv1_006602 (CAS 347352-13-0) is a chemical compound with molecular formula C28H31NO7 and molecular weight 493.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenoxyethyl 2-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_006602, BAS 02841853, A2379/0100616, 2-phenoxyethyl 2-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-phenoxyethyl 2-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,6,7,8-pentahydroq uinoline-3-carboxylate
| Molecular Formula | C28H31NO7 |
|---|---|
| Molecular Weight | 493.21 g/mol |
| LogP | 4.3025 |
| Topological Polar Surface Area | 92.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 493.21005 |
| Heavy Atoms | 36 |
| Complexity | 1199.8789 |
Chemical Identifiers
| CAS Number | 347352-13-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=C(C=C3)OC)OC)OC)C(=O)OCCOC4=CC=CC=C4 |
Product Overview
ChemDiv1_006602 (CAS 347352-13-0), with molecular formula C28H31NO7 and molecular weight 493.21 g/mol. IUPAC: 2-phenoxyethyl 2-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_006602
Property Insights of ChemDiv1_006602
The XLogP value of 4.3025 indicates that ChemDiv1_006602 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.32 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006602. Following Lipinski's Rule of Five, ChemDiv1_006602 has 1 hydrogen bond donor(s) and 8 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_006602?
The CAS number of ChemDiv1_006602 is 347352-13-0.
What is the molecular formula of ChemDiv1_006602?
The molecular formula of ChemDiv1_006602 is C28H31NO7.
What is the molecular weight of ChemDiv1_006602?
The molecular weight of ChemDiv1_006602 is 493.21 g/mol.
Where can I buy ChemDiv1_006602?
You can request a quote for ChemDiv1_006602 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006602?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006602 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.