1-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}-4-methylpiperazine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}-4-methylpiperazine--hydrogen chloride (1/1)
1-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}-4-methylpiperazine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D349-2755 |
| Compound Name: | 1-{4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}-4-methylpiperazine--hydrogen chloride (1/1) |
| Molecular Weight: | 461.9 |
| Molecular Formula: | C21 H23 N5 O5 |
| Salt: | HCl |
| Smiles: | CN1CCN(CC1)c1ccc(cc1[N+]([O-])=O)c1nc(c2ccc(c(c2)OC)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.3535 |
| logD: | 2.8937 |
| logSw: | -3.6954 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.614 |
| InChI Key: | GZNYDLTXCGEIMQ-UHFFFAOYSA-N |