N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
Chemical Structure Depiction of
N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
Compound characteristics
| Compound ID: | Y032-3336 |
| Compound Name: | N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-phenoxybutanamide |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C19 H22 N2 O3 S |
| Smiles: | CC1(C)CC(c2c(C1)nc(NC(CCCOc1ccccc1)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5834 |
| logD: | 3.2855 |
| logSw: | -3.8032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.25 |
| InChI Key: | IZMRPESFSPUSFJ-UHFFFAOYSA-N |