1-benzyl-4-{2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine
Chemical Structure Depiction of
1-benzyl-4-{2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine
1-benzyl-4-{2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine
Compound characteristics
| Compound ID: | D349-3627 |
| Compound Name: | 1-benzyl-4-{2-nitro-4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C22 H25 N5 O3 |
| Smiles: | CC(C)c1nc(c2ccc(c(c2)[N+]([O-])=O)N2CCN(CC2)Cc2ccccc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.3277 |
| logD: | 4.2508 |
| logSw: | -4.3181 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.688 |
| InChI Key: | OKBNZAFJEHOIDQ-UHFFFAOYSA-N |