Basic information
- Standard SMILES
COc1csc(-c2c(-c3c(F)cccc3Cl)noc2-c2cnn(-c3cccc(F)c3)c2C(F)(F)F)n1- InChIKey
RLCVYHXDDHXMOB-UHFFFAOYSA-N- Molecular formula
- C23H12ClF5N4O2S
- Average molar mass
- 538.9 g/mol
Names & identifiers
- Preferred name
- 3-(2-chloro-6-fluorophenyl)-5-(1-(3-fluorophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl)-4-(4-methoxythiazol-2-yl)isoxazole
- IUPAC
- 3-(2-chloro-6-fluorophenyl)-5-[1-(3-fluorophenyl)-5-(trifluoromethyl)pyrazol-4-yl]-4-(4-methoxy-1,3-thiazol-2-yl)-1,2-oxazole
Names & synonyms
3-(2-chloro-6-fluorophenyl)-5-(1-(3-fluorophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl)-4-(4-methoxythiazol-2-yl)isoxazoleSCHEMBL11893406RLCVYHXDDHXMOB-UHFFFAOYSA-NRLCVYHXDDHXMOB-UHFFFAOYSA-O
Database identifiers
- PubChem CID
- 60148751
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 94.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 760
Related reactions
2 records
Compound notes
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