3-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-oxohexyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-oxohexyl)quinazolin-4(3H)-one
3-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-oxohexyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y042-8897 |
| Compound Name: | 3-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-oxohexyl)quinazolin-4(3H)-one |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Smiles: | C(CCC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)CCN1C=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.9674 |
| logD: | 1.6231 |
| logSw: | -2.8848 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.366 |
| InChI Key: | MHGASIRIBDHQOO-UHFFFAOYSA-N |