Basic information
- Standard SMILES
Cn1nc(-c2c(F)cccc2Cl)nc1-c1ccc(COc2ccc(OC(F)(F)F)cc2)c(Cl)c1- InChIKey
OAOVUYGSAGTIMI-UHFFFAOYSA-N- Molecular formula
- C23H15Cl2F4N3O2
- Average molar mass
- 512.3 g/mol
Names & identifiers
- Preferred name
- 3-(2-chloro-6-fluorophenyl)-5-[3-chloro-4-(4-trifluoromethoxyphenoxymethyl)phenyl]-1-methyl-1H-1,2,4-triazole
- IUPAC
- 3-(2-chloro-6-fluorophenyl)-5-[3-chloro-4-[[4-(trifluoromethoxy)phenoxy]methyl]phenyl]-1-methyl-1,2,4-triazole
Names & synonyms
3-(2-chloro-6-fluorophenyl)-5-[3-chloro-4-(4-trifluoromethoxyphenoxymethyl)phenyl]-1-methyl-1H-1,2,4-triazoleSCHEMBL83047873-(2-chloro-6-fluorophenyl)-5-[3-chloro-4(4-trifluoromethoxyphenoxymethyl)phenyl]-1-methyl-1H-1,2,4-triazole
Database identifiers
- PubChem CID
- 21463636
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 656
Related reactions
3 records
Compound notes
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