butyl [(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
butyl [(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate
butyl [(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D360-5951 |
| Compound Name: | butyl [(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 290.38 |
| Molecular Formula: | C15 H18 N2 O2 S |
| Smiles: | CCCCOC(CSc1c(C#N)cc2CCCc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6223 |
| logD: | 3.6223 |
| logSw: | -3.6022 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.282 |
| InChI Key: | VFTZAMZBDAPSTH-UHFFFAOYSA-N |