4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate
Compound characteristics
| Compound ID: | C263-0064 |
| Compound Name: | 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate |
| Molecular Weight: | 450.91 |
| Molecular Formula: | C21 H20 Cl F N2 O4 S |
| Smiles: | Cc1c(c(n(C(C)(C)C)n1)OC(c1c(cccc1[Cl])F)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8774 |
| logD: | 3.8774 |
| logSw: | -4.6799 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.018 |
| InChI Key: | SUBGZJCHXRJPHG-UHFFFAOYSA-N |