ethyl 6-amino-5-cyano-2-phenyl-4-[4-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-phenyl-4-[4-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-phenyl-4-[4-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
Compound characteristics
Compound ID: | 3132-1264 |
Compound Name: | ethyl 6-amino-5-cyano-2-phenyl-4-[4-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate |
Molecular Weight: | 414.38 |
Molecular Formula: | C22 H17 F3 N2 O3 |
Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1c1ccccc1)c1ccc(cc1)C(F)(F)F)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.3721 |
logD: | 4.3721 |
logSw: | -4.5481 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.127 |
InChI Key: | QAUWEABAHOGYRV-QGZVFWFLSA-N |