ethyl 6-amino-5-cyano-2-methyl-4-(2,4,6-trimethyl-3,5-dinitrophenyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-methyl-4-(2,4,6-trimethyl-3,5-dinitrophenyl)-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-methyl-4-(2,4,6-trimethyl-3,5-dinitrophenyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8003-8201 |
| Compound Name: | ethyl 6-amino-5-cyano-2-methyl-4-(2,4,6-trimethyl-3,5-dinitrophenyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 416.39 |
| Molecular Formula: | C19 H20 N4 O7 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C)c1c(C)c(c(C)c(c1C)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4006 |
| logD: | 3.4006 |
| logSw: | -3.6877 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 133.006 |
| InChI Key: | XRODBMNYTAYFTM-OAHLLOKOSA-N |