ethyl ({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
ethyl ({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y502-0241 |
| Compound Name: | ethyl ({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-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/c2cn(C)nc2C)\C1=O)SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 1.2384 |
| logD: | 1.2384 |
| logSw: | -1.6291 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.55 |
| InChI Key: | WOBUHAPVUFJGTB-UHFFFAOYSA-N |