N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(3,4,5-trimethoxyphenyl)ethanediamide
Chemical Structure Depiction of
N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(3,4,5-trimethoxyphenyl)ethanediamide
N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(3,4,5-trimethoxyphenyl)ethanediamide
Compound characteristics
| Compound ID: | C909-0022 |
| Compound Name: | N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(3,4,5-trimethoxyphenyl)ethanediamide |
| Molecular Weight: | 466.49 |
| Molecular Formula: | C24 H26 N4 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7348 |
| logD: | 1.3634 |
| logSw: | -2.5816 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.152 |
| InChI Key: | LIVUOXMDWFGHGA-UHFFFAOYSA-N |