Basic information
- Standard SMILES
Cn1cc(S(=O)(=O)NC2CCc3cc(Cn4cc(CO)c(C(F)(F)F)n4)ccc32)c(C(F)(F)F)n1- InChIKey
PBXHCAPMGJNCRS-UHFFFAOYSA-N- Molecular formula
- C20H19F6N5O3S
- Average molar mass
- 523.5 g/mol
Names & identifiers
- Preferred name
- N-(5-((4-(hydroxymethyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)methyl)-2,3-dihydro-1H-inden-1-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonamide
- IUPAC
- N-[5-[[4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]methyl]-2,3-dihydro-1H-inden-1-yl]-1-methyl-3-(trifluoromethyl)pyrazole-4-sulfonamide
Names & synonyms
CHEMBL1642172SCHEMBL1591994BDBM50417568N-(5-((4-(hydroxymethyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)methyl)-2,3-dihydro-1H-inden-1-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonamideN-[5-[[4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]methyl]-2,3-dihydro-1H-inden-1-yl]-1-methyl-3-(trifluoromethyl)pyrazole-4-sulfonamide
Database identifiers
- PubChem CID
- 53326549
- ChEMBL
CHEMBL1642172
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 854
Related reactions
2 records
Compound notes
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