2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-4,6-dimethylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-4,6-dimethylpyridine-3-carbonitrile
2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-4,6-dimethylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8001-1448 |
| Compound Name: | 2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-4,6-dimethylpyridine-3-carbonitrile |
| Molecular Weight: | 246.33 |
| Molecular Formula: | C13 H14 N2 O S |
| Smiles: | Cc1cc(C)nc(c1C#N)SCC(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6472 |
| logD: | 2.6472 |
| logSw: | -2.5818 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.347 |
| InChI Key: | NCSWTPOBHFZEFU-UHFFFAOYSA-N |