2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8003-0358 |
| Compound Name: | 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 356.51 |
| Molecular Formula: | C19 H20 N2 O S2 |
| Smiles: | CC(C)(C)C(CSc1c(C#N)c(c2CCCc2n1)c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0466 |
| logD: | 5.0466 |
| logSw: | -4.7866 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.823 |
| InChI Key: | PBOKDZKWQZCKEA-UHFFFAOYSA-N |