methyl 3-[6-(4-carbamoylpiperidin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[6-(4-carbamoylpiperidin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-[6-(4-carbamoylpiperidin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K221-2556 |
| Compound Name: | methyl 3-[6-(4-carbamoylpiperidin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C22 H28 N4 O6 |
| Smiles: | COC(c1ccc2C(N(CCCCCC(N3CCC(CC3)C(N)=O)=O)C(Nc2c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1678 |
| logD: | 1.1648 |
| logSw: | -2.2265 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.084 |
| InChI Key: | VNEOELNCFJFCOW-UHFFFAOYSA-N |