BAS 00916016
TL;DR: BAS 00916016 (CAS 5708-96-3) is a chemical compound with molecular formula C29H33NO5 and molecular weight 475.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(2-propan-2-yloxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00916016, ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(2-propan-2-yloxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, ethyl 4-(2-isopropoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, ETHYL 4-(2-ISOPROPOXYPHENYL)-7-(4-METHOXYPHENYL)-2-METHYL-5-OXO-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBOXYLATE
| Molecular Formula | C29H33NO5 |
|---|---|
| Molecular Weight | 475.24 g/mol |
| LogP | 5.4071 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.23587 |
| Heavy Atoms | 35 |
| Complexity | 1175.8132 |
Chemical Identifiers
| CAS Number | 5708-96-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OC(C)C)C(=O)CC(C2)C4=CC=C(C=C4)OC)C |
Product Overview
BAS 00916016 (CAS 5708-96-3), with molecular formula C29H33NO5 and molecular weight 475.24 g/mol. IUPAC: ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(2-propan-2-yloxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00916016
Property Insights of BAS 00916016
The XLogP value of 5.4071 indicates that BAS 00916016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00916016. Following Lipinski's Rule of Five, BAS 00916016 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00916016?
The CAS number of BAS 00916016 is 5708-96-3.
What is the molecular formula of BAS 00916016?
The molecular formula of BAS 00916016 is C29H33NO5.
What is the molecular weight of BAS 00916016?
The molecular weight of BAS 00916016 is 475.24 g/mol.
Where can I buy BAS 00916016?
You can request a quote for BAS 00916016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00916016?
Yes, KEHONG BIO provides custom synthesis services for BAS 00916016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.