2-amino-4-(4-ethoxyphenyl)-8-[(4-ethoxyphenyl)methylidene]-6-ethyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(4-ethoxyphenyl)-8-[(4-ethoxyphenyl)methylidene]-6-ethyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
2-amino-4-(4-ethoxyphenyl)-8-[(4-ethoxyphenyl)methylidene]-6-ethyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Compound characteristics
Compound ID: | 6049-1028 |
Compound Name: | 2-amino-4-(4-ethoxyphenyl)-8-[(4-ethoxyphenyl)methylidene]-6-ethyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile |
Molecular Weight: | 457.57 |
Molecular Formula: | C28 H31 N3 O3 |
Smiles: | CCN1C/C(=C\c2ccc(cc2)OCC)C2=C(C1)C(C(C#N)=C(N)O2)c1ccc(cc1)OCC |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4446 |
logD: | 4.4446 |
logSw: | -4.4519 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.349 |
InChI Key: | XUJXQAZCYLFDEY-AREMUKBSSA-N |