6-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one
6-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0664 |
| Compound Name: | 6-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 501.62 |
| Molecular Formula: | C24 H27 N3 O5 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(/C=C/c1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1392 |
| logD: | 4.1392 |
| logSw: | -4.2886 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.245 |
| InChI Key: | DDDQXUXDASPXJV-UHFFFAOYSA-N |