2-(4-benzylpiperidin-1-yl)-2-oxo-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)acetamide
Chemical Structure Depiction of
2-(4-benzylpiperidin-1-yl)-2-oxo-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)acetamide
2-(4-benzylpiperidin-1-yl)-2-oxo-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)acetamide
Compound characteristics
| Compound ID: | C909-0044 |
| Compound Name: | 2-(4-benzylpiperidin-1-yl)-2-oxo-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)acetamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(C(N1CCC(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.741 |
| logD: | 3.1902 |
| logSw: | -4.1105 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.459 |
| InChI Key: | BBTPIDHZRRSNHO-UHFFFAOYSA-N |