diethyl [3-(3,5-dimethoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamido]propanedioate
Chemical Structure Depiction of
diethyl [3-(3,5-dimethoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamido]propanedioate
diethyl [3-(3,5-dimethoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamido]propanedioate
Compound characteristics
| Compound ID: | K623-0037 |
| Compound Name: | diethyl [3-(3,5-dimethoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamido]propanedioate |
| Molecular Weight: | 646.7 |
| Molecular Formula: | C34 H38 N4 O9 |
| Smiles: | CCOC(C(C(=O)OCC)NC(c1ccc(c(c1)NC(c1cc(cc(c1)OC)OC)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8895 |
| logD: | 3.8768 |
| logSw: | -4.1533 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 122.114 |
| InChI Key: | SIZBALJUYIBDBR-UHFFFAOYSA-N |