2-imino-1-methyl-5-{[4-(methylsulfanyl)phenyl]methylidene}imidazolidin-4-one
Chemical Structure Depiction of
2-imino-1-methyl-5-{[4-(methylsulfanyl)phenyl]methylidene}imidazolidin-4-one
2-imino-1-methyl-5-{[4-(methylsulfanyl)phenyl]methylidene}imidazolidin-4-one
Compound characteristics
| Compound ID: | 4896-2501 |
| Compound Name: | 2-imino-1-methyl-5-{[4-(methylsulfanyl)phenyl]methylidene}imidazolidin-4-one |
| Molecular Weight: | 247.32 |
| Molecular Formula: | C12 H13 N3 O S |
| Smiles: | CN1C(=C/c2ccc(cc2)SC)\C(NC1=N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7993 |
| logD: | 1.7916 |
| logSw: | -2.476 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.126 |
| InChI Key: | LVGSUDOOFHVECH-UHFFFAOYSA-N |