2-[(4-chloro-1,3,5-triazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)propanamide
Basic information
- Standard SMILES
CC(Nc1ncnc(Cl)n1)C(=O)NCC(F)(F)F- InChIKey
MSFDQLJRZSHXIS-UHFFFAOYSA-N- Molecular formula
- C8H9ClF3N5O
- Average molar mass
- 283.64 g/mol
Names & identifiers
- Preferred name
- 2-[(4-chloro-1,3,5-triazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)propanamide
- IUPAC
- 2-[(4-chloro-1,3,5-triazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)propanamide
Names & synonyms
SCHEMBL5136694
Database identifiers
- PubChem CID
- 72476216
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Related reactions
1 records
Compound notes
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