2-amino-7-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-[(pyridin-2-yl)methyl]-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-7-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-[(pyridin-2-yl)methyl]-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
2-amino-7-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-[(pyridin-2-yl)methyl]-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 7706-1058 |
| Compound Name: | 2-amino-7-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-[(pyridin-2-yl)methyl]-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile |
| Molecular Weight: | 416.5 |
| Molecular Formula: | C23 H20 N4 O2 S |
| Smiles: | CC1=CC2=C(C(C(C#N)=C(N)O2)c2ccc(cc2)SC)C(N1Cc1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8018 |
| logD: | 2.8018 |
| logSw: | -3.2177 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.894 |
| InChI Key: | VRXASKMHGKHUKF-HXUWFJFHSA-N |