3-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-6,7-dimethoxyquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-6,7-dimethoxyquinazolin-4(3H)-one
3-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-6,7-dimethoxyquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y042-9969 |
| Compound Name: | 3-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-6,7-dimethoxyquinazolin-4(3H)-one |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C25 H28 N4 O6 |
| Smiles: | COc1cc2C(N(CCC(N3CCN(CC3)Cc3ccc4c(c3)OCO4)=O)C=Nc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3264 |
| logD: | 0.9822 |
| logSw: | -2.2979 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.627 |
| InChI Key: | TUJOKOLUVZFSHE-UHFFFAOYSA-N |