Basic information
- Standard SMILES
CCOC(=O)c1c(N2CCN(C(=O)c3cccs3)CC2)c2cc(F)cnc2n(CC(=O)c2ccccc2)c1=O- InChIKey
PSJAOFHJUROEPO-UHFFFAOYSA-N- Molecular formula
- C28H25FN4O5S
- Average molar mass
- 548.6 g/mol
Names & identifiers
- Preferred name
- 6-Fluoro-2-oxo-1-(2-oxo-2-phenyl-ethyl)-4-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-1,2-dihydro-[1,8]-naphthyridine-3-carboxylic Acid Ethyl Ester
- IUPAC
- ethyl 6-fluoro-2-oxo-1-phenacyl-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylate
Names & synonyms
SCHEMBL4858429PSJAOFHJUROEPO-UHFFFAOYSA-N6-Fluoro-2-oxo-1-(2-oxo-2-phenyl-ethyl)-4-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-1,2-dihydro-[1,8]-naphthyridine-3-carboxylic Acid Ethyl Ester
Database identifiers
- PubChem CID
- 59699619
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 994
Related reactions
2 records
Compound notes
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