BAS 00410703
TL;DR: BAS 00410703 (CAS 5475-79-6) is a chemical compound with molecular formula C23H28ClNO4 and molecular weight 417.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxyethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00410703, 2-ethoxyethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-(ethyloxy)ethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-ethoxyethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, 2-ethoxyethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,7,8-pentahydroqui noline-3-carboxylate
| Molecular Formula | C23H28ClNO4 |
|---|---|
| Molecular Weight | 417.17 g/mol |
| LogP | 4.5237 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.1707 |
| Heavy Atoms | 29 |
| Complexity | 884.61896 |
Chemical Identifiers
| CAS Number | 5475-79-6 |
|---|---|
| SMILES | CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 00410703 (CAS 5475-79-6), with molecular formula C23H28ClNO4 and molecular weight 417.17 g/mol. IUPAC: 2-ethoxyethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00410703
Property Insights of BAS 00410703
The XLogP value of 4.5237 indicates that BAS 00410703 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00410703. Following Lipinski's Rule of Five, BAS 00410703 has 1 hydrogen bond donor(s) and 5 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 BAS 00410703?
The CAS number of BAS 00410703 is 5475-79-6.
What is the molecular formula of BAS 00410703?
The molecular formula of BAS 00410703 is C23H28ClNO4.
What is the molecular weight of BAS 00410703?
The molecular weight of BAS 00410703 is 417.17 g/mol.
Where can I buy BAS 00410703?
You can request a quote for BAS 00410703 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00410703?
Yes, KEHONG BIO provides custom synthesis services for BAS 00410703 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.