2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(pyridin-3-yl)acetamide
Chemical Structure Depiction of
2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(pyridin-3-yl)acetamide
2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(pyridin-3-yl)acetamide
Compound characteristics
| Compound ID: | IB06-4725 |
| Compound Name: | 2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(pyridin-3-yl)acetamide |
| Molecular Weight: | 364.4 |
| Molecular Formula: | C20 H20 N4 O3 |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)OCC(Nc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.78 |
| logD: | 1.78 |
| logSw: | -2.78 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.78 |
| InChI Key: | USKBFHDCZXWERW-UHFFFAOYSA-N |