BAS 00916034
TL;DR: BAS 00916034 (CAS 5717-33-9) is a chemical compound with molecular formula C26H27NO5 and molecular weight 433.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00916034, AB00094534-01, methyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, methyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C26H27NO5 |
|---|---|
| Molecular Weight | 433.19 g/mol |
| LogP | 4.3255 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.18893 |
| Heavy Atoms | 32 |
| Complexity | 1116.2921 |
Chemical Identifiers
| CAS Number | 5717-33-9 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OC)C)O |
Product Overview
BAS 00916034 (CAS 5717-33-9), with molecular formula C26H27NO5 and molecular weight 433.19 g/mol. IUPAC: methyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00916034
Property Insights of BAS 00916034
The XLogP value of 4.3255 indicates that BAS 00916034 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 00916034. Following Lipinski's Rule of Five, BAS 00916034 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 00916034?
The CAS number of BAS 00916034 is 5717-33-9.
What is the molecular formula of BAS 00916034?
The molecular formula of BAS 00916034 is C26H27NO5.
What is the molecular weight of BAS 00916034?
The molecular weight of BAS 00916034 is 433.19 g/mol.
Where can I buy BAS 00916034?
You can request a quote for BAS 00916034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00916034?
Yes, KEHONG BIO provides custom synthesis services for BAS 00916034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.