4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3,5-dimethylbenzoate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3,5-dimethylbenzoate
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3,5-dimethylbenzoate
Compound characteristics
| Compound ID: | C263-0005 |
| Compound Name: | 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 3,5-dimethylbenzoate |
| Molecular Weight: | 426.53 |
| Molecular Formula: | C23 H26 N2 O4 S |
| Smiles: | Cc1cc(C)cc(c1)C(=O)Oc1c(c(C)nn1C(C)(C)C)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9696 |
| logD: | 3.9696 |
| logSw: | -4.1054 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.018 |
| InChI Key: | SNYLNQOPEGWDLL-UHFFFAOYSA-N |