N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide
Chemical Structure Depiction of
N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide
N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide
Compound characteristics
| Compound ID: | Y031-6938 |
| Compound Name: | N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide |
| Molecular Weight: | 280.39 |
| Molecular Formula: | C14 H20 N2 O2 S |
| Smiles: | CCC(C)C(Nc1nc2CC(C)(C)CC(c2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2469 |
| logD: | 2.8058 |
| logSw: | -3.4525 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.317 |
| InChI Key: | GSYROOOESFMPAZ-QMMMGPOBSA-N |