N-(1-benzylpiperidin-4-yl)-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
N-(1-benzylpiperidin-4-yl)-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C260-1578 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide |
| Molecular Weight: | 566.7 |
| Molecular Formula: | C34 H38 N4 O4 |
| Smiles: | CC(C)(C)C(CN1C(N(Cc2ccc(cc2)C(NC2CCN(CC2)Cc2ccccc2)=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3684 |
| logD: | 2.9232 |
| logSw: | -4.2724 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.464 |
| InChI Key: | BQGWQORWAURCNG-UHFFFAOYSA-N |