3-Quinolinecarboxylic acid, 1-(2,4-difluorophenyl)-7-(3-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-8-methoxy-4-oxo-
Basic information
- CAS
183135-71-9- Standard SMILES
CCC1CN(c2c(F)cc3c(=O)c(C(=O)O)cn(-c4ccc(F)cc4F)c3c2OC)CCN1- InChIKey
CVVQZULQONLVPP-UHFFFAOYSA-N- Molecular formula
- C23H22F3N3O4
- Average molar mass
- 461.4 g/mol
- Monoisotopic mass
- 461.15624068
Names & identifiers
- Preferred name
- 3-Quinolinecarboxylic acid, 1-(2,4-difluorophenyl)-7-(3-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-8-methoxy-4-oxo-
- IUPAC
- 1-(2,4-difluorophenyl)-7-(3-ethylpiperazin-1-yl)-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid
Names & synonyms
PD161323183135-71-93-Quinolinecarboxylic acid, 1-(2,4-difluorophenyl)-7-(3-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-8-methoxy-4-oxo-DTXSID809396871-(2,4-Difluorophenyl)-7-(3-ethylpiperazin-1-yl)-6-fluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid1-(2,4-difluorophenyl)-7-(3-ethylpiperazin-1-yl)-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid
Database identifiers
- CAS
183135-71-9- PubChem CID
- 465569
- DTXSID
DTXSID80939687
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 82.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 784
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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