BAS 00411254
TL;DR: BAS 00411254 (CAS 5466-26-2) is a chemical compound with molecular formula C22H26FNO3 and molecular weight 371.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00411254, BIM-0020331.P001, propyl 4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, propyl 4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, propyl 4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C22H26FNO3 |
|---|---|
| Molecular Weight | 371.19 g/mol |
| LogP | 4.3829 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.18967 |
| Heavy Atoms | 27 |
| Complexity | 850.8688 |
Chemical Identifiers
| CAS Number | 5466-26-2 |
|---|---|
| SMILES | CCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)F)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 00411254 (CAS 5466-26-2), with molecular formula C22H26FNO3 and molecular weight 371.19 g/mol. IUPAC: propyl 4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00411254
Property Insights of BAS 00411254
The XLogP value of 4.3829 indicates that BAS 00411254 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 00411254 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00411254 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 00411254?
The CAS number of BAS 00411254 is 5466-26-2.
What is the molecular formula of BAS 00411254?
The molecular formula of BAS 00411254 is C22H26FNO3.
What is the molecular weight of BAS 00411254?
The molecular weight of BAS 00411254 is 371.19 g/mol.
Where can I buy BAS 00411254?
You can request a quote for BAS 00411254 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00411254?
Yes, KEHONG BIO provides custom synthesis services for BAS 00411254 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.