3-(2-chloro-6-fluorophenyl)-5-[2-chloro-4-(3-chloro-5-trifluoromethylpyridine-2-yloxymethyl)phenyl]-1-methyl-1H-1,2,4-triazole

HCID 21463680

Basic information

Standard SMILES
Cn1nc(-c2c(F)cccc2Cl)nc1-c1ccc(COc2ncc(C(F)(F)F)cc2Cl)cc1Cl
InChIKey
NRLKUVSXDJLDRJ-UHFFFAOYSA-N
Molecular formula
C22H13Cl3F4N4O
Average molar mass
531.7 g/mol

Names & identifiers

Preferred name
3-(2-chloro-6-fluorophenyl)-5-[2-chloro-4-(3-chloro-5-trifluoromethylpyridine-2-yloxymethyl)phenyl]-1-methyl-1H-1,2,4-triazole
IUPAC
3-chloro-2-[[3-chloro-4-[5-(2-chloro-6-fluorophenyl)-2-methyl-1,2,4-triazol-3-yl]phenyl]methoxy]-5-(trifluoromethyl)pyridine

Names & synonyms

3-(2-chloro-6-fluorophenyl)-5-[2-chloro-4-(3-chloro-5-trifluoromethylpyridine-2-yloxymethyl)phenyl]-1-methyl-1H-1,2,4-triazoleSCHEMBL83016283-(2-chloro-6-fluorophenyl)-5-[2-chloro-4(3-chloro-5-trifluoromethylpyridine-2-yloxymethyl)phenyl]1-methyl-1H-1,2,4-triazole

Database identifiers

PubChem CID
21463680

Properties

Computed structural properties

XLogP
6.9
Topological polar surface area
52.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
34

Related reactions

3 records

Compound notes

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