2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | IB05-4200 |
| Compound Name: | 2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C25 H27 N3 O3 |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)OCC(NC1CCCc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.44 |
| logD: | 3.44 |
| logSw: | -4.57 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.25 |
| InChI Key: | CCWHMSVWXSYUIG-NRFANRHFSA-N |