2-{2-oxo-2-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]ethyl}-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Chemical Structure Depiction of
2-{2-oxo-2-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]ethyl}-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
2-{2-oxo-2-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]ethyl}-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Compound characteristics
| Compound ID: | D257-0693 |
| Compound Name: | 2-{2-oxo-2-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]ethyl}-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | C1CN(CCN1C/C=C/c1ccccc1)C(CN1C(c2ccccc2S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5486 |
| logD: | 1.5469 |
| logSw: | -2.5318 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.095 |
| InChI Key: | SNZTZKBMLMSQGT-UHFFFAOYSA-N |