N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0096 |
| Compound Name: | N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 480.4 |
| Molecular Formula: | C19 H18 Br N3 O3 S2 |
| Smiles: | Cc1ccc(cc1[Br])NC(c1cc(c2cccs2)n(C2CCS(C2)(=O)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.52 |
| logD: | 3.5197 |
| logSw: | -3.6985 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.441 |
| InChI Key: | GXPNJCPCBHLNRN-AWEZNQCLSA-N |