N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide
N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | E002-2572 |
| Compound Name: | N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-nitrobenzamide |
| Molecular Weight: | 500.51 |
| Molecular Formula: | C27 H24 N4 O6 |
| Smiles: | COc1cccc(c1)N1CCN(CC1)C(c1c(c2ccccc2o1)NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1819 |
| logD: | 2.8015 |
| logSw: | -4.3841 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.294 |
| InChI Key: | CDUXERKHHVAPOC-UHFFFAOYSA-N |