2-[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
2-[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y040-5682 |
| Compound Name: | 2-[(1'-acetyl-4-oxo-3,4-dihydrospiro[[1]benzopyran-2,4'-piperidin]-7-yl)oxy]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | CC(N1CCC2(CC1)CC(c1ccc(cc1O2)OCC(Nc1nc(C)c(C)s1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3879 |
| logD: | 2.298 |
| logSw: | -3.1968 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.418 |
| InChI Key: | GRVJWJXYZRFPGF-UHFFFAOYSA-N |