BAS 03049539
TL;DR: BAS 03049539 (CAS 303101-06-6) is a chemical compound with molecular formula C21H24FNO3 and molecular weight 357.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 03049539, ethyl 4-(2-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, ethyl 4-(2-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, ethyl 4-(2-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, ethyl 4-(2-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,7,8-pentahydroquinoline-3 -carboxylate
| Molecular Formula | C21H24FNO3 |
|---|---|
| Molecular Weight | 357.17 g/mol |
| LogP | 3.9928 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.174 |
| Heavy Atoms | 26 |
| Complexity | 835.4129 |
Chemical Identifiers
| CAS Number | 303101-06-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3F)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 03049539 (CAS 303101-06-6), with molecular formula C21H24FNO3 and molecular weight 357.17 g/mol. IUPAC: ethyl 4-(2-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 03049539
Property Insights of BAS 03049539
The XLogP value of 3.9928 indicates that BAS 03049539 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 03049539 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03049539 has 1 hydrogen bond donor(s) and 4 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 03049539?
The CAS number of BAS 03049539 is 303101-06-6.
What is the molecular formula of BAS 03049539?
The molecular formula of BAS 03049539 is C21H24FNO3.
What is the molecular weight of BAS 03049539?
The molecular weight of BAS 03049539 is 357.17 g/mol.
Where can I buy BAS 03049539?
You can request a quote for BAS 03049539 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03049539?
Yes, KEHONG BIO provides custom synthesis services for BAS 03049539 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.