Basic information
- Standard SMILES
Cn1nc(-c2c(F)cccc2F)nc1-c1ccc(Oc2ncc(C(F)(F)F)cc2Cl)c(Cl)c1- InChIKey
WFVBABXUYBVNOO-UHFFFAOYSA-N- Molecular formula
- C21H11Cl2F5N4O
- Average molar mass
- 501.2 g/mol
Names & identifiers
- Preferred name
- 5-[3-chloro-4-(3-chloro-5-trifluoromethylpyridine-2-yloxy)phenyl]-3-(2,6-difluorophenyl)-1-methyl-1H-1,2,4-triazole
- IUPAC
- 3-chloro-2-[2-chloro-4-[5-(2,6-difluorophenyl)-2-methyl-1,2,4-triazol-3-yl]phenoxy]-5-(trifluoromethyl)pyridine
Names & synonyms
5-[3-chloro-4-(3-chloro-5-trifluoromethylpyridine-2-yloxy)phenyl]-3-(2,6-difluorophenyl)-1-methyl-1H-1,2,4-triazoleSCHEMBL83048635-[3-chloro-4-(3-chloro-5-trifluoromethylpyridine-2-yloxy)phenyl]3-(2,6-difluorophenyl)-1-methyl-1H-1,2,4-triazole
Database identifiers
- PubChem CID
- 21463624
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 655
Related reactions
2 records
Compound notes
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