Basic information
- Standard SMILES
COC(C)(OC)c1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(N)c1SC- InChIKey
GUWCUSNNFKDDJC-UHFFFAOYSA-N- Molecular formula
- C15H16Cl2F3N3O2S
- Average molar mass
- 430.3 g/mol
Names & identifiers
- Preferred name
- 5-amino-1-[2,6-dichloro4-(trifluoromethyl)phenyl]-3-[(1,1-dimethoxy)ethyl]4-methylthio-1H-pyrazole
- IUPAC
- 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-(1,1-dimethoxyethyl)-4-methylsulfanylpyrazol-5-amine
Names & synonyms
5-amino-1-[2,6-dichloro4-(trifluoromethyl)phenyl]-3-[(1,1-dimethoxy)ethyl]4-methylthio-1H-pyrazoleSCHEMBL69625565-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-[(1,1-dimethoxy)ethyl]-4-methylthio-1H-pyrazole
Database identifiers
- PubChem CID
- 11059059
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 87.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 476
Related reactions
3 records
Compound notes
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