Basic information
- CAS
489424-15-9- Standard SMILES
CC1CCc2cc(F)cc3c(O)c(C(=O)Nc4cccnc4)c(=O)n1c23- InChIKey
CHPCRXYYRRHCHN-UHFFFAOYSA-N- Molecular formula
- C19H16FN3O3
- Average molar mass
- 353.3 g/mol
- Monoisotopic mass
- 353.11756954
Names & identifiers
- Preferred name
- 9-fluoro-1-hydroxy-5-methyl-3-oxo-N-(pyridin-3-yl)-3,5,6,7-tetrahydropyrido[3,2,1-ij]quinoline-2-carboxamide
- IUPAC
- 7-fluoro-4-hydroxy-12-methyl-2-oxo-N-pyridin-3-yl-1-azatricyclo[7.3.1.05,13]trideca-3,5,7,9(13)-tetraene-3-carboxamide
- English name
- 9-fluoro-1-hydroxy-5-methyl-3-oxo-N-(pyridin-3-yl)-3,5,6,7-tetrahydropyrido[3,2,1-ij]quinoline-2-carboxamide
- Molecular formula
- C19H16FN3O3
- Molecular weight
- 353.35
Names & synonyms
CHEMBL4442529SCHEMBL23375379STL569492AKOS000626316AKOS022104340AKOS037625275EU-0032464ST50021811SR-01000589238SR-01000589238-19-fluoro-1-hydroxy-5-methyl-3-oxo-N-(pyridin-3-yl)-3,5,6,7-tetrahydropyrido[3,2,1-ij]quinoline-2-carboxamide9-fluoro-3-hydroxy-5-methyl-1-oxo-N-(pyridin-3-yl)-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-2-carboxamide
Show more names
1H,5H-Benzo[ij]quinolizine-6-carboxamide, 9-fluoro-2,3-dihydro-7-hydroxy-3-methyl-5-oxo-N-3-pyridinyl-
9-fluoro-7-hydroxy-3-methyl-5-oxo-N-(3-pyridinyl)-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxamide
Database identifiers
- CAS
489424-15-9- PubChem CID
- 54679461
- ChEMBL
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 82.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 638
Chemistry & industry
Suppliers2 total
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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