ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(3,4-dimethoxyphenyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(3,4-dimethoxyphenyl)-4H-pyran-3-carboxylate
ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(3,4-dimethoxyphenyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8020-2239 |
| Compound Name: | ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(3,4-dimethoxyphenyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 378.81 |
| Molecular Formula: | C18 H19 Cl N2 O5 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C[Cl])c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0648 |
| logD: | 2.0648 |
| logSw: | -2.7006 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.901 |
| InChI Key: | UJALIOAOXTUTJU-HNNXBMFYSA-N |