Basic information
- Standard SMILES
Cn1c(-c2cccc(C(F)(F)F)c2)nc2c(NC(=O)c3ccccn3)cccc2c1=O- InChIKey
FHLJIOYSKRKCES-UHFFFAOYSA-N- Molecular formula
- C22H15F3N4O2
- Average molar mass
- 424.4 g/mol
- Monoisotopic mass
- 424.11471022
Names & identifiers
- Preferred name
- N-(3-methyl-4-oxo-2-(3-(trifluoromethyl)phenyl)-3,4-dihydroquinazolin-8-yl)picolinamide
- IUPAC
- N-[3-methyl-4-oxo-2-[3-(trifluoromethyl)phenyl]quinazolin-8-yl]pyridine-2-carboxamide
Names & synonyms
N-(3-methyl-4-oxo-2-(3-(trifluoromethyl)phenyl)-3,4-dihydroquinazolin-8-yl)picolinamideSCHEMBL9980916
Database identifiers
- PubChem CID
- 45255149
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 74.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 726
Related reactions
1 records
Compound notes
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