4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 4-methoxybenzoate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 4-methoxybenzoate
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | C263-0057 |
| Compound Name: | 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 4-methoxybenzoate |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C22 H24 N2 O5 S |
| Smiles: | Cc1c(c(n(C(C)(C)C)n1)OC(c1ccc(cc1)OC)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4513 |
| logD: | 3.4513 |
| logSw: | -3.8376 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.562 |
| InChI Key: | WRKFIHKJHSYXOL-UHFFFAOYSA-N |