N~1~-[2-(morpholin-4-yl)ethyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide
Chemical Structure Depiction of
N~1~-[2-(morpholin-4-yl)ethyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide
N~1~-[2-(morpholin-4-yl)ethyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide
Compound characteristics
| Compound ID: | C909-0056 |
| Compound Name: | N~1~-[2-(morpholin-4-yl)ethyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide |
| Molecular Weight: | 413.48 |
| Molecular Formula: | C21 H27 N5 O4 |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(C(NCCN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1775 |
| logD: | -0.0951 |
| logSw: | -2.2388 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.228 |
| InChI Key: | NQYMGAJQCLHNOH-UHFFFAOYSA-N |