4-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
4-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
4-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8014-3796 |
| Compound Name: | 4-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C26 H24 N2 O2 S |
| Smiles: | Cc1ccc(cc1)C(CSc1c(C#N)c(c2ccc(cc2)OC)c2CCCCc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2827 |
| logD: | 6.2827 |
| logSw: | -5.4379 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.711 |
| InChI Key: | RMISXZSCNXAHLI-UHFFFAOYSA-N |