1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-1H-pyrrol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-1H-pyrrol-1-yl]ethan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-1H-pyrrol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | L505-2510 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-1H-pyrrol-1-yl]ethan-1-one |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C24 H27 N5 O4 |
| Smiles: | C1CC(C1)c1nnc(c2cccn2CC(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.1708 |
| logD: | 1.9793 |
| logSw: | -2.5403 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.644 |
| InChI Key: | ZEBHZEGRFTXTTG-UHFFFAOYSA-N |