Basic information
- Standard SMILES
Cc1nc(C(F)(F)F)ccc1Cn1nc2c(-c3ccncc3)c(-c3ccc(Cl)cc3)cc(C)n2c1=O- InChIKey
AVJLUXSPMRNZKP-UHFFFAOYSA-N- Molecular formula
- C26H19ClF3N5O
- Average molar mass
- 509.9 g/mol
- Monoisotopic mass
- 509.1230224
Names & identifiers
- Preferred name
- 7-(4-chlorophenyl)-5-methyl-2-((2-methyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-8-(pyridin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
- IUPAC
- 7-(4-chlorophenyl)-5-methyl-2-[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]methyl]-8-pyridin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-3-one
Names & synonyms
7-(4-chlorophenyl)-5-methyl-2-((2-methyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-8-(pyridin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-oneSCHEMBL4476513
Database identifiers
- PubChem CID
- 57799439
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 950
Related reactions
4 records
Compound notes
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