N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide
Chemical Structure Depiction of
N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide
N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide
Compound characteristics
| Compound ID: | Y031-2566 |
| Compound Name: | N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(4-methylbenzene-1-sulfonyl)acetamide |
| Molecular Weight: | 392.49 |
| Molecular Formula: | C18 H20 N2 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(CC(Nc1nc2CC(C)(C)CC(c2s1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.946 |
| logD: | 2.563 |
| logSw: | -3.4683 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.868 |
| InChI Key: | UZNBJWXZTWQACM-UHFFFAOYSA-N |