3-{[(3-methylphenyl)methyl]sulfanyl}-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Chemical Structure Depiction of
3-{[(3-methylphenyl)methyl]sulfanyl}-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
3-{[(3-methylphenyl)methyl]sulfanyl}-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Compound characteristics
| Compound ID: | 6049-2408 |
| Compound Name: | 3-{[(3-methylphenyl)methyl]sulfanyl}-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile |
| Molecular Weight: | 348.39 |
| Molecular Formula: | C18 H15 F3 N2 S |
| Smiles: | Cc1cccc(CSc2c(C#N)c3CCCc3c(C(F)(F)F)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5945 |
| logD: | 5.5945 |
| logSw: | -5.5695 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.8273 |
| InChI Key: | NPLHBSMOHFNOQZ-UHFFFAOYSA-N |