4-tert-butyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-tert-butyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)cyclohexane-1-carboxamide
4-tert-butyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C803-0278 |
| Compound Name: | 4-tert-butyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 395.54 |
| Molecular Formula: | C24 H33 N3 O2 |
| Smiles: | CC(C)(C)C1CCC(CC1)C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2181 |
| logD: | 5.218 |
| logSw: | -4.873 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.003 |
| InChI Key: | ZCWDFOQOAIGDJK-UHFFFAOYSA-N |