3-cyclopropyl-5-[(3-nitrophenyl)methylidene]-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Chemical Structure Depiction of
3-cyclopropyl-5-[(3-nitrophenyl)methylidene]-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
3-cyclopropyl-5-[(3-nitrophenyl)methylidene]-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Compound characteristics
| Compound ID: | Y501-7274 |
| Compound Name: | 3-cyclopropyl-5-[(3-nitrophenyl)methylidene]-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one |
| Molecular Weight: | 289.31 |
| Molecular Formula: | C13 H11 N3 O3 S |
| Smiles: | C1CC1N1C(=NC(=C/c2cccc(c2)[N+]([O-])=O)\C1=O)S |
| Stereo: | ACHIRAL |
| logP: | 2.2799 |
| logD: | 0.6512 |
| logSw: | -2.6569 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.673 |
| InChI Key: | BFBYWPFRTQLVHM-UHFFFAOYSA-N |