1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | G307-1771 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C21 H27 N5 O6 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(Cn1cc(nc1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0838 |
| logD: | -0.2753 |
| logSw: | -2.1127 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.744 |
| InChI Key: | FUKREBRWZLRGIN-UHFFFAOYSA-N |