ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8014-9734 |
| Compound Name: | ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 453.41 |
| Molecular Formula: | C20 H19 N7 O6 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)N(C=1C)c1c(NC(C)=O)non1)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9299 |
| logD: | 0.4113 |
| logSw: | -2.5864 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 152.615 |
| InChI Key: | PCBWENNSMXEJEM-MRXNPFEDSA-N |