ethyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
ethyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | Y501-3763 |
| Compound Name: | ethyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate |
| Molecular Weight: | 470.93 |
| Molecular Formula: | C25 H24 Cl F N2 O4 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C)c1cc(COc2ccc(cc2[Cl])F)c(C)cc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1211 |
| logD: | 5.1211 |
| logSw: | -5.497 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.76 |
| InChI Key: | SXDLIBUGCFRBNR-HSZRJFAPSA-N |