ethyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
Compound characteristics
Compound ID: | 8001-1347 |
Compound Name: | ethyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate |
Molecular Weight: | 353.2 |
Molecular Formula: | C16 H14 Cl2 N2 O3 |
Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C)c1ccc(cc1[Cl])[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7804 |
logD: | 3.7804 |
logSw: | -4.3272 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.446 |
InChI Key: | MJJFIRGQPDKMJU-CQSZACIVSA-N |