Basic information
- Standard SMILES
O=C(O)c1cn(CCO)c2c(F)c(N3CCn4ccnc4C3)c(F)cc2c1=O- InChIKey
ORCRQECGJKZGEM-UHFFFAOYSA-N- Molecular formula
- C18H16F2N4O4
- Average molar mass
- 390.3 g/mol
- Monoisotopic mass
- 390.11396133
Names & identifiers
- Preferred name
- 1-(2-Hydroxyethyl)-6,8-difluoro-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-7-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
- IUPAC
- 7-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6,8-difluoro-1-(2-hydroxyethyl)-4-oxoquinoline-3-carboxylic acid
Names & synonyms
SCHEMBL7017211ORCRQECGJKZGEM-UHFFFAOYSA-N1-(2-Hydroxyethyl)-6,8-difluoro-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-7-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
Database identifiers
- PubChem CID
- 15411481
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 98.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 678
Related reactions
4 records
Compound notes
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