2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y505-4984 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)sulfanyl]-1-[3-(4-methylbenzene-1-sulfonyl)imidazolidin-1-yl]ethan-1-one |
| Molecular Weight: | 417.5 |
| Molecular Formula: | C19 H19 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(N1CCN(C1)C(CSc1nc2ccccc2o1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6185 |
| logD: | 3.6185 |
| logSw: | -3.5681 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.647 |
| InChI Key: | NZPQBADYZFTGOT-UHFFFAOYSA-N |