2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-9175 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 340.42 |
| Molecular Formula: | C19 H17 F N2 O S |
| Smiles: | Cc1c2CCCCc2nc(c1C#N)SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5246 |
| logD: | 4.5246 |
| logSw: | -4.5324 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.439 |
| InChI Key: | FXEUOOJJEYVXEH-UHFFFAOYSA-N |