BAS 00915211
TL;DR: BAS 00915211 (CAS 4529-13-9) is a chemical compound with molecular formula C23H28BrNO5 and molecular weight 477.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00915211, ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 3-methyl-2-(1-oxohexadecylamino)butanoic acid, ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, ETHYL 4-(3-BROMO-5-ETHOXY-4-HYDROXY-PHENYL)-2,7,7-TRIMETHYL-5-OXO-1,4,6,8-TETRAHYDROQUINOLINE-3-CARBOXYLATE
| Molecular Formula | C23H28BrNO5 |
|---|---|
| Molecular Weight | 477.12 g/mol |
| LogP | 4.7205 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.11508 |
| Heavy Atoms | 30 |
| Complexity | 960.5853 |
Chemical Identifiers
| CAS Number | 4529-13-9 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCC)C)Br)O |
Product Overview
BAS 00915211 (CAS 4529-13-9), with molecular formula C23H28BrNO5 and molecular weight 477.12 g/mol. IUPAC: ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00915211
Property Insights of BAS 00915211
The XLogP value of 4.7205 indicates that BAS 00915211 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00915211. Following Lipinski's Rule of Five, BAS 00915211 has 2 hydrogen bond donor(s) and 6 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 00915211?
The CAS number of BAS 00915211 is 4529-13-9.
What is the molecular formula of BAS 00915211?
The molecular formula of BAS 00915211 is C23H28BrNO5.
What is the molecular weight of BAS 00915211?
The molecular weight of BAS 00915211 is 477.12 g/mol.
Where can I buy BAS 00915211?
You can request a quote for BAS 00915211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00915211?
Yes, KEHONG BIO provides custom synthesis services for BAS 00915211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.