{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanone
Compound characteristics
| Compound ID: | S341-0450 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanone |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | Cc1ccc(cc1)c1nc(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.269 |
| logD: | 3.074 |
| logSw: | -3.1023 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.22 |
| InChI Key: | HSQYHMKZDNOQOO-UHFFFAOYSA-N |