1-benzyl-4-{2-nitro-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine
Chemical Structure Depiction of
1-benzyl-4-{2-nitro-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine
1-benzyl-4-{2-nitro-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine
Compound characteristics
Compound ID: | D349-3414 |
Compound Name: | 1-benzyl-4-{2-nitro-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]phenyl}piperazine |
Molecular Weight: | 442.48 |
Molecular Formula: | C24 H22 N6 O3 |
Smiles: | C1CN(CCN1Cc1ccccc1)c1ccc(cc1[N+]([O-])=O)c1nc(c2ccccn2)no1 |
Stereo: | ACHIRAL |
logP: | 3.8536 |
logD: | 3.7767 |
logSw: | -4.1997 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 80.465 |
InChI Key: | JKARWQBLHBBLAE-UHFFFAOYSA-N |