N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide
N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | E002-2511 |
| Compound Name: | N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide |
| Molecular Weight: | 488.46 |
| Molecular Formula: | C25 H20 N4 O7 |
| Smiles: | C1CN(CCN1C(c1ccco1)=O)C(c1c(c2ccccc2o1)NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6468 |
| logD: | 1.2664 |
| logSw: | -3.2217 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.524 |
| InChI Key: | ADMKIWUFCSBZQI-UHFFFAOYSA-N |