2-amino-4-(2H-1,3-benzodioxol-5-yl)-6-benzyl-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2H-1,3-benzodioxol-5-yl)-6-benzyl-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
2-amino-4-(2H-1,3-benzodioxol-5-yl)-6-benzyl-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 7706-1272 |
| Compound Name: | 2-amino-4-(2H-1,3-benzodioxol-5-yl)-6-benzyl-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C24 H19 N3 O4 |
| Smiles: | CC1=CC2=C(C(C(C#N)=C(N)O2)c2ccc3c(c2)OCO3)C(N1Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3218 |
| logD: | 3.3218 |
| logSw: | -3.7257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.466 |
| InChI Key: | KSIADTVUCPKXDZ-OAQYLSRUSA-N |