3,3-dimethyl-8-(morpholin-4-yl)-6-{[(4-nitrophenyl)methyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Chemical Structure Depiction of
3,3-dimethyl-8-(morpholin-4-yl)-6-{[(4-nitrophenyl)methyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
3,3-dimethyl-8-(morpholin-4-yl)-6-{[(4-nitrophenyl)methyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | 8113-0063 |
| Compound Name: | 3,3-dimethyl-8-(morpholin-4-yl)-6-{[(4-nitrophenyl)methyl]sulfanyl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Smiles: | CC1(C)Cc2c(CO1)c(nc(c2C#N)SCc1ccc(cc1)[N+]([O-])=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3525 |
| logD: | 4.3525 |
| logSw: | -4.5654 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.063 |
| InChI Key: | OSYCZTBMYNJTET-UHFFFAOYSA-N |