1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-{4-[(3-methoxycarbonylpropyl)-carbamoyl]-piperazin-1-yl}-quinoline-3-carboxylic acid
Basic information
- Standard SMILES
COC(=O)CCCNC(=O)N1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1- InChIKey
LGVVLBGRPDANSS-UHFFFAOYSA-N- Molecular formula
- C23H27FN4O6
- Average molar mass
- 474.5 g/mol
Names & identifiers
- Preferred name
- 1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-{4-[(3-methoxycarbonylpropyl)-carbamoyl]-piperazin-1-yl}-quinoline-3-carboxylic acid
- IUPAC
- 1-cyclopropyl-6-fluoro-7-[4-[(4-methoxy-4-oxobutyl)carbamoyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
Names & synonyms
SCHEMBL10809875LGVVLBGRPDANSS-UHFFFAOYSA-N1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-{4-[(3-methoxycarbonylpropyl)-carbamoyl]-piperazin-1-yl}-quinoline-3-carboxylic acid
Database identifiers
- PubChem CID
- 13340211
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 854
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Related reactions
1 records
Compound notes
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