4-(2-chlorophenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
4-(2-chlorophenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
4-(2-chlorophenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8004-3972 |
| Compound Name: | 4-(2-chlorophenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 300.81 |
| Molecular Formula: | C16 H13 Cl N2 S |
| Smiles: | C1CCC2=C(C1)C(=C(C#N)C(N2)=S)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.212 |
| logD: | 1.6604 |
| logSw: | -4.5892 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.7896 |
| InChI Key: | QRBKHKLMGMOSDG-UHFFFAOYSA-N |