2-(2,4-dichlorophenoxy)-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)propanamide
Chemical Structure Depiction of
2-(2,4-dichlorophenoxy)-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)propanamide
2-(2,4-dichlorophenoxy)-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)propanamide
Compound characteristics
| Compound ID: | C803-0365 |
| Compound Name: | 2-(2,4-dichlorophenoxy)-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)propanamide |
| Molecular Weight: | 446.33 |
| Molecular Formula: | C22 H21 Cl2 N3 O3 |
| Smiles: | CC(C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=O)Oc1ccc(cc1[Cl])[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5095 |
| logD: | 4.5094 |
| logSw: | -4.5609 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.687 |
| InChI Key: | IZEZUITVJXQFDR-ZDUSSCGKSA-N |