ethyl ({1-ethyl-4-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({1-ethyl-4-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
ethyl ({1-ethyl-4-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y502-0242 |
| Compound Name: | ethyl ({1-ethyl-4-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C15 H20 N4 O3 S |
| Smiles: | CCN1C(=NC(=C/c2cnn(CC)c2)\C1=O)SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 1.4612 |
| logD: | 1.4612 |
| logSw: | -1.6708 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.889 |
| InChI Key: | OPDKGLFHHPDHDI-UHFFFAOYSA-N |