12-oxo-N-(4-phenylbutan-2-yl)-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
12-oxo-N-(4-phenylbutan-2-yl)-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
12-oxo-N-(4-phenylbutan-2-yl)-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | C849-0531 |
| Compound Name: | 12-oxo-N-(4-phenylbutan-2-yl)-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 389.5 |
| Molecular Formula: | C24 H27 N3 O2 |
| Smiles: | CC(CCc1ccccc1)NC(c1ccc2C(N3CCCCCC3=Nc2c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2059 |
| logD: | 3.2059 |
| logSw: | -3.639 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.575 |
| InChI Key: | UIRIYEYZMRPHSY-KRWDZBQOSA-N |