2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}imidazolidine
Chemical Structure Depiction of
2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}imidazolidine
2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}imidazolidine
Compound characteristics
| Compound ID: | 4872-0087 |
| Compound Name: | 2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}imidazolidine |
| Molecular Weight: | 346.23 |
| Molecular Formula: | C13 H13 Cl2 N3 O2 S |
| Smiles: | Cc1ccc(cc1)SC(C(=C1NCCN1)[N+]([O-])=O)=C([Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6278 |
| logD: | 3.6278 |
| logSw: | -3.9481 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.362 |
| InChI Key: | PZAZUDAZSZHGCY-UHFFFAOYSA-N |