4,5,6-trimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile
Chemical Structure Depiction of
4,5,6-trimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile
4,5,6-trimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8004-3985 |
| Compound Name: | 4,5,6-trimethyl-2-sulfanylidene-1,2-dihydropyridine-3-carbonitrile |
| Molecular Weight: | 178.25 |
| Molecular Formula: | C9 H10 N2 S |
| Smiles: | CC1C(C)=C(C)NC(C=1C#N)=S |
| Stereo: | ACHIRAL |
| logP: | 1.9604 |
| logD: | -0.0263 |
| logSw: | -2.0954 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.7419 |
| InChI Key: | PLYXVRVYCQKRHS-UHFFFAOYSA-N |