Basic information
- Standard SMILES
CN(c1ccccc1)c1ncnc2cc(C(F)(F)F)ccc12- InChIKey
NSCRIMVWSSNPQO-UHFFFAOYSA-N- Molecular formula
- C16H12F3N3
- Average molar mass
- 303.28 g/mol
- Monoisotopic mass
- 303.09833188
Names & identifiers
- Preferred name
- 4-(N-Methylanilino)-7-trifluoromethylquinazoline
- IUPAC
- N-methyl-N-phenyl-7-(trifluoromethyl)quinazolin-4-amine
Names & synonyms
4-(N-Methylanilino)-7-trifluoromethylquinazolineSCHEMBL11085844
Database identifiers
- PubChem CID
- 12774516
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 29 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 368
Related reactions
3 records
Compound notes
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