2-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
2-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8011-0039 |
| Compound Name: | 2-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 539.52 |
| Molecular Formula: | C26 H16 Cl2 N2 O S3 |
| Smiles: | C1Cc2c(c(C#N)c(nc2C/1=C\c1cccs1)SCC(c1ccc(cc1[Cl])[Cl])=O)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 7.9088 |
| logD: | 7.9088 |
| logSw: | -6.9904 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.659 |
| InChI Key: | AYECNNRNIVXRHA-UHFFFAOYSA-N |