2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-1,2-benzothiazol-3(2H)-one
2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | E022-1264 |
| Compound Name: | 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(CCCN1C(c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4004 |
| logD: | 2.4 |
| logSw: | -2.679 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.802 |
| InChI Key: | HQSOWDKVDASSDN-UHFFFAOYSA-N |