Basic information
- Standard SMILES
Cn1c(C2c3n[nH]c(=O)c4cccc(c34)NC2c2ccc(F)cc2)nc2cnccc21- InChIKey
SYKVBQHDIBKULJ-UHFFFAOYSA-N- Molecular formula
- C23H17FN6O
- Average molar mass
- 412.4 g/mol
Names & identifiers
- Preferred name
- 8-(4-Fluorophenyl)-9-(1-methyl-1H-imidazo[4,5-c]pyridin-2-yl)-8,9-dihydro-2H-pyrido[4,3,2-de]phthalazin-3(7H)-one
- IUPAC
- 11-(4-fluorophenyl)-12-(1-methylimidazo[4,5-c]pyridin-2-yl)-2,3,10-triazatricyclo[7.3.1.05,13]trideca-1,5(13),6,8-tetraen-4-one
Names & synonyms
SCHEMBL2314634SYKVBQHDIBKULJ-UHFFFAOYSA-N8-(4-Fluorophenyl)-9-(1-methyl-1H-imidazo[4,5-c]pyridin-2-yl)-8,9-dihydro-2H-pyrido[4,3,2-de]phthalazin-3(7H)-one
Database identifiers
- PubChem CID
- 136265173
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 740
Related reactions
3 records
Compound notes
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