4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 5-bromofuran-2-carboxylate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 5-bromofuran-2-carboxylate
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 5-bromofuran-2-carboxylate
Compound characteristics
| Compound ID: | C263-0021 |
| Compound Name: | 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 5-bromofuran-2-carboxylate |
| Molecular Weight: | 467.34 |
| Molecular Formula: | C19 H19 Br N2 O5 S |
| Smiles: | Cc1c(c(n(C(C)(C)C)n1)OC(c1ccc(o1)[Br])=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4715 |
| logD: | 3.4715 |
| logSw: | -3.8956 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.944 |
| InChI Key: | SERUBIXHEDSZML-UHFFFAOYSA-N |