2-{[(4-chlorophenyl)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-chlorophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
2-{[(4-chlorophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
Compound ID: | 8011-0033 |
Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile |
Molecular Weight: | 477.07 |
Molecular Formula: | C25 H17 Cl N2 S3 |
Smiles: | C1Cc2c(c(C#N)c(nc2C/1=C\c1cccs1)SCc1ccc(cc1)[Cl])c1cccs1 |
Stereo: | ACHIRAL |
logP: | 7.35 |
logD: | 7.35 |
logSw: | -7.0344 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 28.4117 |
InChI Key: | JFOCPCZFFSUESH-UHFFFAOYSA-N |