1-(4-methoxyphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,4-dione
Chemical Structure Depiction of
1-(4-methoxyphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,4-dione
1-(4-methoxyphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,4-dione
Compound characteristics
| Compound ID: | K809-0532 |
| Compound Name: | 1-(4-methoxyphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]butane-1,4-dione |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C21 H23 N3 O5 |
| Smiles: | COc1ccc(cc1)C(CCC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8215 |
| logD: | 2.8215 |
| logSw: | -3.732 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.792 |
| InChI Key: | HAMODLAEBDLRKP-UHFFFAOYSA-N |