2-sulfanylidene-2,5,6,7-tetrahydro-1H-cyclopenta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-sulfanylidene-2,5,6,7-tetrahydro-1H-cyclopenta[b]pyridine-3-carbonitrile
2-sulfanylidene-2,5,6,7-tetrahydro-1H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4111-1314 |
| Compound Name: | 2-sulfanylidene-2,5,6,7-tetrahydro-1H-cyclopenta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 176.24 |
| Molecular Formula: | C9 H8 N2 S |
| Smiles: | C1CC2C=C(C#N)C(NC=2C1)=S |
| Stereo: | ACHIRAL |
| logP: | 1.5708 |
| logD: | 0.9826 |
| logSw: | -2.031 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.4272 |
| InChI Key: | JPCVQCHARWIKEH-UHFFFAOYSA-N |