6-{4-[3-(thiophen-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[3-(thiophen-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
6-{4-[3-(thiophen-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0135 |
| Compound Name: | 6-{4-[3-(thiophen-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C18 H17 N3 O4 S3 |
| Smiles: | C1CN(CCN1C(/C=C/c1cccs1)=O)S(c1ccc2c(c1)SC(N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4557 |
| logD: | 2.434 |
| logSw: | -2.987 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.044 |
| InChI Key: | JIQJLXLYWOHVQT-UHFFFAOYSA-N |