methyl 3-{6-[(1-benzylpiperidin-4-yl)amino]-6-oxohexyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-{6-[(1-benzylpiperidin-4-yl)amino]-6-oxohexyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-{6-[(1-benzylpiperidin-4-yl)amino]-6-oxohexyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K221-2542 |
| Compound Name: | methyl 3-{6-[(1-benzylpiperidin-4-yl)amino]-6-oxohexyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C28 H34 N4 O5 |
| Smiles: | COC(c1ccc2C(N(CCCCCC(NC3CCN(CC3)Cc3ccccc3)=O)C(Nc2c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.331 |
| logD: | 1.7733 |
| logSw: | -3.6617 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.37 |
| InChI Key: | DMEIGNDDBDIXMU-UHFFFAOYSA-N |