3,3-dimethyl-8-(morpholin-4-yl)-6-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Chemical Structure Depiction of
3,3-dimethyl-8-(morpholin-4-yl)-6-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
3,3-dimethyl-8-(morpholin-4-yl)-6-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | D396-0159 |
| Compound Name: | 3,3-dimethyl-8-(morpholin-4-yl)-6-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C21 H28 N4 O4 S |
| Smiles: | CC1(C)Cc2c(CO1)c(nc(c2C#N)SCC(N1CCOCC1)=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.2065 |
| logD: | 2.2065 |
| logSw: | -2.1237 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.983 |
| InChI Key: | NPYZKJZGTNOKKR-UHFFFAOYSA-N |