2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide
2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K940-0169 |
| Compound Name: | 2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 498.39 |
| Molecular Formula: | C20 H24 Br N3 O5 S |
| Smiles: | COc1ccc(cc1OC)NC(CN1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1204 |
| logD: | 3.1203 |
| logSw: | -3.3696 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.9 |
| InChI Key: | TXWPLGZQWGWYPU-UHFFFAOYSA-N |