Basic information
- Standard SMILES
Cc1ccc(-c2nc(-c3ccccc3Cl)nn2C)cc1Oc1ccc(C(F)(F)F)cn1- InChIKey
SUUSXEYQRRCMLV-UHFFFAOYSA-N- Molecular formula
- C22H16ClF3N4O
- Average molar mass
- 444.8 g/mol
Names & identifiers
- Preferred name
- 3-(2-chlorophenyl)-1-methyl-5-[4-methyl-3-(5-trifluoromethylpyridine-2-yloxy)phenyl]-1H-1,2,4-triazole
- IUPAC
- 2-[5-[5-(2-chlorophenyl)-2-methyl-1,2,4-triazol-3-yl]-2-methylphenoxy]-5-(trifluoromethyl)pyridine
Names & synonyms
3-(2-chlorophenyl)-1-methyl-5-[4-methyl-3-(5-trifluoromethylpyridine-2-yloxy)phenyl]-1H-1,2,4-triazoleSCHEMBL83008333-(2-chlorophenyl)-1-methyl-5-[4-methyl-3-(5-trifluoromethylpyridine 2-yloxy)phenyl]-1H-1,2,4triazole
Database identifiers
- PubChem CID
- 21463643
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 598
Related reactions
2 records
Compound notes
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