2-amino-5-oxo-4-(propan-2-yl)-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-oxo-4-(propan-2-yl)-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
2-amino-5-oxo-4-(propan-2-yl)-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Compound characteristics
Compound ID: | 2188-1683 |
Compound Name: | 2-amino-5-oxo-4-(propan-2-yl)-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile |
Molecular Weight: | 282.3 |
Molecular Formula: | C16 H14 N2 O3 |
Smiles: | CC(C)C1C(C#N)=C(N)OC2=C1C(=O)Oc1ccccc12 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0496 |
logD: | 2.0496 |
logSw: | -2.7633 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.971 |
InChI Key: | VJYKIYYCRDQCAM-GFCCVEGCSA-N |