4-(tert-butyl)-N-[3-[2-(4-fluorophenoxy)ethoxy]-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-yl]benzenesulfonamide
Basic information
- Standard SMILES
Cc1ccc(-c2c(OCCOc3ccc(F)cc3)nn(C)c2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1- InChIKey
VJLNBFJSSMIIFS-UHFFFAOYSA-N- Molecular formula
- C29H32FN3O4S
- Average molar mass
- 537.6 g/mol
Names & identifiers
- Preferred name
- 4-(tert-butyl)-N-[3-[2-(4-fluorophenoxy)ethoxy]-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-yl]benzenesulfonamide
- IUPAC
- 4-tert-butyl-N-[3-[2-(4-fluorophenoxy)ethoxy]-1-methyl-4-(4-methylphenyl)pyrazol-5-yl]benzenesulfonamide
Names & synonyms
SCHEMBL6289314VJLNBFJSSMIIFS-UHFFFAOYSA-N4-(tert-butyl)-N-[3-[2-(4-fluorophenoxy)ethoxy]-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-yl]benzenesulfonamide
Database identifiers
- PubChem CID
- 22282005
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 90.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 824
Related reactions
3 records
Compound notes
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