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Basic information
- Standard SMILES
Cc1ccc(-n2cc(C(C)(C)N)nn2)cc1C(=O)c1ccc(Nc2ccc(F)cc2F)cc1Cl- InChIKey
FLJGZIISKFQLIJ-UHFFFAOYSA-N- Molecular formula
- C25H22ClF2N5O
- Average molar mass
- 481.9 g/mol
Names & identifiers
- Preferred name
- {5-[4-(1-Amino-1-methyl-ethyl)-[1,2,3]triazol-1-yl]-2-methyl-phenyl}-[2-chloro-4-(2,4-difluoro-phenylamino)-phenyl]-methanone
- IUPAC
- [5-[4-(2-aminopropan-2-yl)triazol-1-yl]-2-methylphenyl]-[2-chloro-4-(2,4-difluoroanilino)phenyl]methanone
Names & synonyms
SCHEMBL2850877FLJGZIISKFQLIJ-UHFFFAOYSA-N{5-[4-(1-Amino-1-methyl-ethyl)-[1,2,3]triazol-1-yl]-2-methyl-phenyl}-[2-chloro-4-(2,4-difluoro-phenylamino)-phenyl]-methanone
Database identifiers
- PubChem CID
- 11627155
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 715
Related reactions
1 records
Compound notes
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