2-(3,4-dihydroisoquinolin-2(1H)-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | 5633-3549 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C21 H20 N2 O3 S |
| Smiles: | COc1ccc(/C=C2/C(N=C(N3CCc4ccccc4C3)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6003 |
| logD: | 3.6003 |
| logSw: | -3.7473 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.518 |
| InChI Key: | FGUCSSWHLIZSDL-UHFFFAOYSA-N |