ethyl 3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
Chemical Structure Depiction of
ethyl 3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
ethyl 3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
Compound characteristics
| Compound ID: | E616-1104 |
| Compound Name: | ethyl 3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate |
| Molecular Weight: | 472.5 |
| Molecular Formula: | C23 H28 N4 O7 |
| Smiles: | CCOC(N1CCC2(CC1)C(=C(C)C(=O)O2)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.417 |
| logD: | 2.417 |
| logSw: | -2.4258 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 97.134 |
| InChI Key: | ABUUAULTCWLTJE-UHFFFAOYSA-N |