1-benzyl-4-{4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}piperazine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-benzyl-4-{4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}piperazine--hydrogen chloride (1/1)
1-benzyl-4-{4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}piperazine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D349-2420 |
| Compound Name: | 1-benzyl-4-{4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitrophenyl}piperazine--hydrogen chloride (1/1) |
| Molecular Weight: | 491.98 |
| Molecular Formula: | C26 H25 N5 O3 |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)c1nc(c2ccc(c(c2)[N+]([O-])=O)N2CCN(CC2)Cc2ccccc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.5986 |
| logD: | 5.5217 |
| logSw: | -5.6282 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.417 |
| InChI Key: | YWRRGCYTIHDDAU-UHFFFAOYSA-N |