2-{[(4-cyanophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(4-cyanophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
2-{[(4-cyanophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8011-0042 |
| Compound Name: | 2-{[(4-cyanophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 467.63 |
| Molecular Formula: | C26 H17 N3 S3 |
| Smiles: | C1Cc2c(c(C#N)c(nc2C/1=C\c1cccs1)SCc1ccc(C#N)cc1)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 6.4097 |
| logD: | 6.4097 |
| logSw: | -6.3439 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.468 |
| InChI Key: | YOPGEWHVGRJXTE-UHFFFAOYSA-N |