7-(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,2,4-oxadiazol-3-yl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,2,4-oxadiazol-3-yl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one
7-(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,2,4-oxadiazol-3-yl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | M338-0156 |
| Compound Name: | 7-(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,2,4-oxadiazol-3-yl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 477.48 |
| Molecular Formula: | C24 H23 N5 O6 |
| Smiles: | CN1C(COc2cc(ccc12)c1nc(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.955 |
| logD: | 1.7657 |
| logSw: | -2.5661 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.087 |
| InChI Key: | FXKGVPWKTPTBEQ-UHFFFAOYSA-N |