Basic information
- Standard SMILES
Cc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(-c4cncc(C(C)(C)C#N)c4)cc3c21- InChIKey
FUTLJGVRPWZGDS-UHFFFAOYSA-N- Molecular formula
- C25H23N7O
- Average molar mass
- 437.5 g/mol
- Monoisotopic mass
- 437.19640838
Names & identifiers
- Preferred name
- 2-{5-[1-(1,3-Dimethyl-1H-pyrazol-4-yl)-3-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-8-yl]-pyridin-3-yl}-2-methyl-propionitrile
- IUPAC
- 2-[5-[1-(1,3-dimethylpyrazol-4-yl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-8-yl]-3-pyridinyl]-2-methylpropanenitrile
Names & synonyms
SCHEMBL3513656FUTLJGVRPWZGDS-UHFFFAOYSA-N2-{5-[1-(1,3-Dimethyl-1H-pyrazol-4-yl)-3-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-8-yl]-pyridin-3-yl}-2-methyl-propionitrile
Database identifiers
- PubChem CID
- 59619879
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 90.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 808
Related reactions
2 records
Compound notes
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