N-benzyl-2-{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetamide
N-benzyl-2-{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D396-0170 |
| Compound Name: | N-benzyl-2-{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetamide |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C24 H28 N4 O3 S |
| Smiles: | CC1(C)Cc2c(CO1)c(nc(c2C#N)SCC(NCc1ccccc1)=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.7837 |
| logD: | 3.7837 |
| logSw: | -4.219 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.153 |
| InChI Key: | KHGCPKNPKVLVRB-UHFFFAOYSA-N |