3-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-2-oxo-N-(1,3-thiazol-2-yl)propanamide
Chemical Structure Depiction of
3-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-2-oxo-N-(1,3-thiazol-2-yl)propanamide
3-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-2-oxo-N-(1,3-thiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | 8017-1467 |
| Compound Name: | 3-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-2-oxo-N-(1,3-thiazol-2-yl)propanamide |
| Molecular Weight: | 327.4 |
| Molecular Formula: | C17 H17 N3 O2 S |
| Smiles: | CC1(C)Cc2ccccc2/C(=C/C(C(Nc2nccs2)=O)=O)N1 |
| Stereo: | ACHIRAL |
| logP: | 3.1105 |
| logD: | 3.0834 |
| logSw: | -3.6202 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.078 |
| InChI Key: | GCHMMPLFBKKYRQ-UHFFFAOYSA-N |