4-(4-methoxyphenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
4-(4-methoxyphenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
4-(4-methoxyphenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8003-0428 |
| Compound Name: | 4-(4-methoxyphenyl)-2-sulfanylidene-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 296.39 |
| Molecular Formula: | C17 H16 N2 O S |
| Smiles: | COc1ccc(cc1)C1=C(C#N)C(NC2CCCCC1=2)=S |
| Stereo: | ACHIRAL |
| logP: | 3.748 |
| logD: | 2.1266 |
| logSw: | -4.0353 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.333 |
| InChI Key: | GEAYTMBRNRHJQO-UHFFFAOYSA-N |