2-[(1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
2-[(1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 6995-0171 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C19 H19 N3 O3 S3 |
| Smiles: | Cc1ccc(cc1)S(N1CCN(C1)C(CSc1nc2ccccc2s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1526 |
| logD: | 4.1526 |
| logSw: | -4.0789 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.065 |
| InChI Key: | CWJXNJLFDMVAEF-UHFFFAOYSA-N |