6-{[(2-chlorophenyl)methyl]sulfanyl}-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Chemical Structure Depiction of
6-{[(2-chlorophenyl)methyl]sulfanyl}-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
6-{[(2-chlorophenyl)methyl]sulfanyl}-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | D396-0153 |
| Compound Name: | 6-{[(2-chlorophenyl)methyl]sulfanyl}-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile |
| Molecular Weight: | 429.97 |
| Molecular Formula: | C22 H24 Cl N3 O2 S |
| Smiles: | CC1(C)Cc2c(CO1)c(nc(c2C#N)SCc1ccccc1[Cl])N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.3632 |
| logD: | 5.3632 |
| logSw: | -6.1193 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.682 |
| InChI Key: | GZJQREUFFIIEGX-UHFFFAOYSA-N |