ChemDiv1_002357
TL;DR: ChemDiv1_002357 (CAS 303207-84-3) is a chemical compound with molecular formula C32H29NO6 and molecular weight 523.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 4-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_002357, BAS 01052137, benzyl 4-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, benzyl 4-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, benzyl 4-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C32H29NO6 |
|---|---|
| Molecular Weight | 523.20 g/mol |
| LogP | 5.5289 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 523.19946 |
| Heavy Atoms | 39 |
| Complexity | 1488.7986 |
Chemical Identifiers
| CAS Number | 303207-84-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC5=C(C=C4)OCO5)C(=O)OCC6=CC=CC=C6 |
Product Overview
ChemDiv1_002357 (CAS 303207-84-3), with molecular formula C32H29NO6 and molecular weight 523.20 g/mol. IUPAC: benzyl 4-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_002357
Property Insights of ChemDiv1_002357
The XLogP value of 5.5289 indicates that ChemDiv1_002357 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_002357. Following Lipinski's Rule of Five, ChemDiv1_002357 has 1 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_002357?
The CAS number of ChemDiv1_002357 is 303207-84-3.
What is the molecular formula of ChemDiv1_002357?
The molecular formula of ChemDiv1_002357 is C32H29NO6.
What is the molecular weight of ChemDiv1_002357?
The molecular weight of ChemDiv1_002357 is 523.20 g/mol.
Where can I buy ChemDiv1_002357?
You can request a quote for ChemDiv1_002357 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002357?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002357 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.