5-ethyl-4,6-dimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile
Chemical Structure Depiction of
5-ethyl-4,6-dimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile
5-ethyl-4,6-dimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 0655-0099 |
| Compound Name: | 5-ethyl-4,6-dimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile |
| Molecular Weight: | 192.28 |
| Molecular Formula: | C10 H12 N2 S |
| Smiles: | CCC1C(C)=C(C#N)C(NC=1C)=S |
| Stereo: | ACHIRAL |
| logP: | 2.3881 |
| logD: | 0.8405 |
| logSw: | -2.3997 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.7419 |
| InChI Key: | IMLGWNWCXQYTLB-UHFFFAOYSA-N |