N-benzyl-2-({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
N-benzyl-2-({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y501-9748 |
| Compound Name: | N-benzyl-2-({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 397.5 |
| Molecular Formula: | C20 H23 N5 O2 S |
| Smiles: | CCN1C(=NC(=C\c2cn(C)nc2C)\C1=O)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7086 |
| logD: | 1.7085 |
| logSw: | -2.1177 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.591 |
| InChI Key: | ZFXBLPSGLAMSEV-UHFFFAOYSA-N |