2-(2-nitrophenyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(2-nitrophenyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
2-(2-nitrophenyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y205-5330 |
| Compound Name: | 2-(2-nitrophenyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 327.34 |
| Molecular Formula: | C16 H17 N5 O3 |
| Smiles: | C(C(N1CCN(CC1)c1ncccn1)=O)c1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2265 |
| logD: | 2.2265 |
| logSw: | -2.2564 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.063 |
| InChI Key: | VFBWYBPECZFPNZ-UHFFFAOYSA-N |