N-(3-bromophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
N-(3-bromophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D473-1895 |
| Compound Name: | N-(3-bromophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 490.37 |
| Molecular Formula: | C21 H20 Br N3 O4 S |
| Smiles: | COc1ccc(cc1)c1cc(C(Nc2cccc(c2)[Br])=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5544 |
| logD: | 3.5542 |
| logSw: | -3.8795 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.967 |
| InChI Key: | QZHWEJOQSZFQOC-KRWDZBQOSA-N |