N-{4-oxo-5-[(3-phenyl-1-propanoyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazolidin-2-ylidene}propanamide
Chemical Structure Depiction of
N-{4-oxo-5-[(3-phenyl-1-propanoyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazolidin-2-ylidene}propanamide
N-{4-oxo-5-[(3-phenyl-1-propanoyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazolidin-2-ylidene}propanamide
Compound characteristics
| Compound ID: | 3951-0058 |
| Compound Name: | N-{4-oxo-5-[(3-phenyl-1-propanoyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazolidin-2-ylidene}propanamide |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C19 H18 N4 O3 S |
| Smiles: | CCC(/N=C1\NC(/C(=C/c2cn(C(CC)=O)nc2c2ccccc2)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7652 |
| logD: | 1.091 |
| logSw: | -2.3857 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.962 |
| InChI Key: | YNSYXEYKIDWNDT-UHFFFAOYSA-N |