4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl naphthalene-2-carboxylate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl naphthalene-2-carboxylate
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl naphthalene-2-carboxylate
Compound characteristics
| Compound ID: | C263-0077 |
| Compound Name: | 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl naphthalene-2-carboxylate |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C25 H24 N2 O4 S |
| Smiles: | Cc1c(c(n(C(C)(C)C)n1)OC(c1ccc2ccccc2c1)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5916 |
| logD: | 4.5916 |
| logSw: | -4.8932 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.746 |
| InChI Key: | KWMGBNHDPCPXII-UHFFFAOYSA-N |