methyl 4-(N'-nitrocarbamimidoyl)piperazine-1-carboxylate
Chemical Structure Depiction of
methyl 4-(N'-nitrocarbamimidoyl)piperazine-1-carboxylate
methyl 4-(N'-nitrocarbamimidoyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | 4877-0083 |
| Compound Name: | methyl 4-(N'-nitrocarbamimidoyl)piperazine-1-carboxylate |
| Molecular Weight: | 231.21 |
| Molecular Formula: | C7 H13 N5 O4 |
| Smiles: | COC(N1CCN(CC1)C(/N)=N/[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.8189 |
| logD: | -1.0682 |
| logSw: | -0.248 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.762 |
| InChI Key: | LVLROZMCONPOMK-UHFFFAOYSA-N |