ethyl 4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
Chemical Structure Depiction of
ethyl 4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
ethyl 4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
Compound characteristics
| Compound ID: | 8002-7106 |
| Compound Name: | ethyl 4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate |
| Molecular Weight: | 304.37 |
| Molecular Formula: | C15 H16 N2 O3 S |
| Smiles: | CCOC(CC(CSc1c(C#N)cc2CCCc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3375 |
| logD: | 2.3374 |
| logSw: | -2.5557 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.743 |
| InChI Key: | HVLNOCYDURSSHZ-UHFFFAOYSA-N |