6,7-dimethoxy-3-{3-oxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]propyl}quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
6,7-dimethoxy-3-{3-oxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]propyl}quinazoline-2,4(1H,3H)-dione
6,7-dimethoxy-3-{3-oxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]propyl}quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C191-0068 |
| Compound Name: | 6,7-dimethoxy-3-{3-oxo-3-[4-(pyrimidin-2-yl)piperazin-1-yl]propyl}quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 440.46 |
| Molecular Formula: | C21 H24 N6 O5 |
| Smiles: | COc1cc2C(N(CCC(N3CCN(CC3)c3ncccn3)=O)C(Nc2cc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0619 |
| logD: | 1.042 |
| logSw: | -2.2657 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.735 |
| InChI Key: | JKFXBKVBKJPVTL-UHFFFAOYSA-N |