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Basic information
- Standard SMILES
CNC(=O)c1ccc(NC2(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)CC2)cc1F- InChIKey
PPHAZSBGFLQOOG-UHFFFAOYSA-N- Molecular formula
- C20H16F4N4O2
- Average molar mass
- 420.4 g/mol
- Monoisotopic mass
- 420.12093841
Names & identifiers
- Preferred name
- 4-(1-(4-cyano-3-(trifluoromethyl)phenylcarbamoyl)cyclopropylamino)-2-fluoro-N-methylbenzamide
- IUPAC
- 4-[[1-[[4-cyano-3-(trifluoromethyl)phenyl]carbamoyl]cyclopropyl]amino]-2-fluoro-N-methylbenzamide
Names & synonyms
4-(1-(4-cyano-3-(trifluoromethyl)phenylcarbamoyl)cyclopropylamino)-2-fluoro-N-methylbenzamideSCHEMBL14801601
Database identifiers
- PubChem CID
- 51349335
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 715
Related reactions
2 records
Compound notes
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