2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethan-1-one
2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | K940-0139 |
| Compound Name: | 2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 453.35 |
| Molecular Formula: | C19 H21 Br N2 O4 S |
| Smiles: | COc1cccc(c1)C(CN1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3244 |
| logD: | 3.3244 |
| logSw: | -3.7154 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.28 |
| InChI Key: | JHXHWMMWGGLKOO-UHFFFAOYSA-N |