BAS 00667813
TL;DR: BAS 00667813 (CAS 379246-68-1) is a chemical compound with molecular formula C19H20FNO3 and molecular weight 329.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00667813, J2.207.425C, ethyl 4-(4-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 4-(4-Fluoro-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic, ethyl 4-(4-fluorophenyl)-2-methyl-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carbox ylate
| Molecular Formula | C19H20FNO3 |
|---|---|
| Molecular Weight | 329.14 g/mol |
| LogP | 3.3567 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.14273 |
| Heavy Atoms | 24 |
| Complexity | 746.3803 |
Chemical Identifiers
| CAS Number | 379246-68-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)F)C(=O)CCC2)C |
Product Overview
BAS 00667813 (CAS 379246-68-1), with molecular formula C19H20FNO3 and molecular weight 329.14 g/mol. IUPAC: ethyl 4-(4-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00667813
Property Insights of BAS 00667813
The XLogP value of 3.3567 indicates that BAS 00667813 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 00667813 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00667813 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 00667813?
The CAS number of BAS 00667813 is 379246-68-1.
What is the molecular formula of BAS 00667813?
The molecular formula of BAS 00667813 is C19H20FNO3.
What is the molecular weight of BAS 00667813?
The molecular weight of BAS 00667813 is 329.14 g/mol.
Where can I buy BAS 00667813?
You can request a quote for BAS 00667813 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00667813?
Yes, KEHONG BIO provides custom synthesis services for BAS 00667813 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.