2-amino-4-(3-methoxyphenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(3-methoxyphenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
2-amino-4-(3-methoxyphenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Compound characteristics
Compound ID: | 8003-4507 |
Compound Name: | 2-amino-4-(3-methoxyphenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile |
Molecular Weight: | 346.34 |
Molecular Formula: | C20 H14 N2 O4 |
Smiles: | COc1cccc(c1)C1C(C#N)=C(N)OC2=C1C(=O)Oc1ccccc12 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4691 |
logD: | 2.4691 |
logSw: | -3.0082 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.243 |
InChI Key: | LDSUAIRLGVEHFA-MRXNPFEDSA-N |