3-bromo-N-{2-[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]ethyl}benzamide
Chemical Structure Depiction of
3-bromo-N-{2-[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]ethyl}benzamide
3-bromo-N-{2-[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | F744-0167 |
| Compound Name: | 3-bromo-N-{2-[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]ethyl}benzamide |
| Molecular Weight: | 482.39 |
| Molecular Formula: | C20 H24 Br N3 O4 S |
| Smiles: | COc1ccc(cc1)S(N1CCN(CCNC(c2cccc(c2)[Br])=O)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7483 |
| logD: | 2.7469 |
| logSw: | -3.5103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.538 |
| InChI Key: | HBJSTMDHUPTWBO-UHFFFAOYSA-N |