2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 6995-0181 |
| Compound Name: | 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one |
| Molecular Weight: | 477.62 |
| Molecular Formula: | C21 H23 N3 O4 S3 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)SCC(N1CCN(C1)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5967 |
| logD: | 4.5966 |
| logSw: | -4.4014 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.189 |
| InChI Key: | GYFRSZMVEAGRIO-UHFFFAOYSA-N |