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Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate
TL;DR: Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate (CAS 931358-98-4) is a chemical compound with molecular formula C19H16FNO3 and molecular weight 325.11142 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate
Also Known As: VU0512166-1, ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate, 1-(3-Fluoro-benzyl)-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester, ethyl 1-[(3-fluorophenyl)methyl]-4-oxo-1,4-dihydroquinoline-3-carboxylate, F3167-1137
Technical Specifications
| Molecular Formula | C19H16FNO3 |
| Molecular Weight | 325.11142 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.11142 Da |
| Heavy Atoms | 24 |
| Complexity | 519.0 |
| SMILES | CCOC(=O)C1=CN(C2=CC=CC=C2C1=O)CC3=CC(=CC=C3)F |
| InChIKey | VKQYMZNTNWEPDD-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate
Property Insights of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate
The XLogP value of 3.7 indicates that Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.6 Ų, Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate?
The CAS number of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate is 931358-98-4.
What is the molecular formula of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate?
The molecular formula of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate is C19H16FNO3.
What is the molecular weight of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate?
The molecular weight of Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate is 325.11142 g/mol.
Where can I buy Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate?
You can request a quote for Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 1-[(3-fluorophenyl)methyl]-4-oxoquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.