1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one
Compound characteristics
| Compound ID: | E613-0057 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one |
| Molecular Weight: | 479.49 |
| Molecular Formula: | C25 H25 N3 O7 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(COCc1cc(c2ccc3c(c2)OCO3)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5305 |
| logD: | 2.231 |
| logSw: | -2.7895 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.596 |
| InChI Key: | GZVCNMSURZQQEB-UHFFFAOYSA-N |