BAS 02226040
TL;DR: BAS 02226040 (CAS 494194-18-2) is a chemical compound with molecular formula C39H37NO6 and molecular weight 615.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 02226040, Benzyl 4-(2-(benzyloxy)phenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, benzyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, 4-(2-Benzyloxy-phenyl)-7-(3,4-dimethoxy-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid benzyl ester, benzyl 4-[2-(benzyloxy)phenyl]-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C39H37NO6 |
|---|---|
| Molecular Weight | 615.26 g/mol |
| LogP | 7.3878 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 615.2621 |
| Heavy Atoms | 46 |
| Complexity | 1793.9237 |
Chemical Identifiers
| CAS Number | 494194-18-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4OCC5=CC=CC=C5)C(=O)OCC6=CC=CC=C6 |
Product Overview
BAS 02226040 (CAS 494194-18-2), with molecular formula C39H37NO6 and molecular weight 615.26 g/mol. IUPAC: benzyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 02226040
Property Insights of BAS 02226040
The XLogP value of 7.3878 indicates that BAS 02226040 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 BAS 02226040. Following Lipinski's Rule of Five, BAS 02226040 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 BAS 02226040?
The CAS number of BAS 02226040 is 494194-18-2.
What is the molecular formula of BAS 02226040?
The molecular formula of BAS 02226040 is C39H37NO6.
What is the molecular weight of BAS 02226040?
The molecular weight of BAS 02226040 is 615.26 g/mol.
Where can I buy BAS 02226040?
You can request a quote for BAS 02226040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02226040?
Yes, KEHONG BIO provides custom synthesis services for BAS 02226040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.