5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3,4-oxadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3,4-oxadiazole-2-carboxamide
5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3,4-oxadiazole-2-carboxamide
Compound characteristics
| Compound ID: | C301-2924 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3,4-oxadiazole-2-carboxamide |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C24 H27 N5 O4 |
| Smiles: | C(CNC(c1nnc(Cc2ccc3c(c2)OCO3)o1)=O)CN1CCN(CC1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2286 |
| logD: | 1.6848 |
| logSw: | -2.8724 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.033 |
| InChI Key: | AVSTWUABHCTRBB-UHFFFAOYSA-N |