4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3-(trifluoromethyl)benzoate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3-(trifluoromethyl)benzoate
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3-(trifluoromethyl)benzoate
Compound characteristics
| Compound ID: | C263-0060 |
| Compound Name: | 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3-(trifluoromethyl)benzoate |
| Molecular Weight: | 466.48 |
| Molecular Formula: | C22 H21 F3 N2 O4 S |
| Smiles: | Cc1c(c(n(C(C)(C)C)n1)OC(c1cccc(c1)C(F)(F)F)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1521 |
| logD: | 4.1521 |
| logSw: | -4.4605 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.018 |
| InChI Key: | FQGIRBGXMWSWBB-UHFFFAOYSA-N |