4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]benzonitrile
Chemical Structure Depiction of
4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]benzonitrile
4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]benzonitrile
Compound characteristics
| Compound ID: | 3229-2694 |
| Compound Name: | 4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]benzonitrile |
| Molecular Weight: | 229.26 |
| Molecular Formula: | C11 H7 N3 O S |
| Smiles: | C(=C1/C(NC(N1)=S)=O)/c1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.3805 |
| logD: | 1.3597 |
| logSw: | -2.1562 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.35 |
| InChI Key: | KWSVIUYGNGTGLM-UHFFFAOYSA-N |