{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[3-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[3-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[3-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]methanone
Compound characteristics
| Compound ID: | E240-0307 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[3-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]methanone |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C24 H25 N3 O6 |
| Smiles: | COc1ccc(cc1OC)c1cc(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.906 |
| logD: | 2.7184 |
| logSw: | -3.141 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.339 |
| InChI Key: | JLSCAZTUHMZDKA-UHFFFAOYSA-N |