4-[(5-nitro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)methyl]piperazine-1-carbaldehyde
Chemical Structure Depiction of
4-[(5-nitro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)methyl]piperazine-1-carbaldehyde
4-[(5-nitro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)methyl]piperazine-1-carbaldehyde
Compound characteristics
| Compound ID: | K028-0013 |
| Compound Name: | 4-[(5-nitro-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)methyl]piperazine-1-carbaldehyde |
| Molecular Weight: | 318.29 |
| Molecular Formula: | C14 H14 N4 O5 |
| Smiles: | [H]C(N1CCN(CC1)CN1C(C(c2cc(ccc12)[N+]([O-])=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0264 |
| logD: | -0.0274 |
| logSw: | -2.2898 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.13 |
| InChI Key: | QKEDSDCQHJDTIX-UHFFFAOYSA-N |