3-{[5-(methylsulfanyl)-2-sulfanylidene-2H-1,3-dithiol-4-yl]sulfanyl}propanenitrile
Chemical Structure Depiction of
3-{[5-(methylsulfanyl)-2-sulfanylidene-2H-1,3-dithiol-4-yl]sulfanyl}propanenitrile
3-{[5-(methylsulfanyl)-2-sulfanylidene-2H-1,3-dithiol-4-yl]sulfanyl}propanenitrile
Compound characteristics
| Compound ID: | 4454-0036 |
| Compound Name: | 3-{[5-(methylsulfanyl)-2-sulfanylidene-2H-1,3-dithiol-4-yl]sulfanyl}propanenitrile |
| Molecular Weight: | 265.46 |
| Molecular Formula: | C7 H7 N S5 |
| Smiles: | CSC1=C(SCCC#N)SC(=S)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.2487 |
| logD: | 3.2487 |
| logSw: | -3.2825 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 18.2883 |
| InChI Key: | PAYMBFHSLAITNH-UHFFFAOYSA-N |