1-(2H-1,3-benzodioxol-5-yl)-4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitrophenyl]piperazine
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitrophenyl]piperazine
1-(2H-1,3-benzodioxol-5-yl)-4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitrophenyl]piperazine
Compound characteristics
| Compound ID: | D349-3131 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitrophenyl]piperazine |
| Molecular Weight: | 409.4 |
| Molecular Formula: | C20 H19 N5 O5 |
| Smiles: | Cc1nc(c2ccc(c(c2)[N+]([O-])=O)N2CCN(CC2)c2ccc3c(c2)OCO3)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.3271 |
| logD: | 3.3271 |
| logSw: | -3.6917 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 88.136 |
| InChI Key: | NCXMLCLJRMMYTJ-UHFFFAOYSA-N |