2-amino-6-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-6-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
2-amino-6-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 7706-1226 |
| Compound Name: | 2-amino-6-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile |
| Molecular Weight: | 443.46 |
| Molecular Formula: | C25 H21 N3 O5 |
| Smiles: | CC1=CC2=C(C(C(C#N)=C(N)O2)c2ccccc2OC)C(N1Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4469 |
| logD: | 3.4469 |
| logSw: | -3.7989 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.097 |
| InChI Key: | DALKRPCWQQSYDY-JOCHJYFZSA-N |