N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-2-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-2-[3-(trifluoromethyl)phenyl]acetamide
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-2-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C803-0315 |
| Compound Name: | N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-2-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 415.41 |
| Molecular Formula: | C22 H20 F3 N3 O2 |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(Cc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6325 |
| logD: | 3.6324 |
| logSw: | -4.0068 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.597 |
| InChI Key: | DKUBSTMPRVZBFK-UHFFFAOYSA-N |