ethyl 2-{2-oxo[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)amino]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-oxo[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)amino]acetamido}benzoate
ethyl 2-{2-oxo[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)amino]acetamido}benzoate
Compound characteristics
| Compound ID: | C909-0074 |
| Compound Name: | ethyl 2-{2-oxo[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)amino]acetamido}benzoate |
| Molecular Weight: | 448.48 |
| Molecular Formula: | C24 H24 N4 O5 |
| Smiles: | CCOC(c1ccccc1NC(C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8207 |
| logD: | 1.057 |
| logSw: | -3.561 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.23 |
| InChI Key: | DMQLUAUSVQWSAB-UHFFFAOYSA-N |