N-(3-acetylphenyl)-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)benzamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-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)benzamide
N-(3-acetylphenyl)-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)benzamide
Compound characteristics
Compound ID: | K623-0015 |
Compound Name: | N-(3-acetylphenyl)-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)benzamide |
Molecular Weight: | 606.68 |
Molecular Formula: | C35 H34 N4 O6 |
Smiles: | CC(c1cccc(c1)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: | 5.2488 |
logD: | 5.1961 |
logSw: | -5.0567 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.488 |
InChI Key: | NBDIASWSQBRUDJ-UHFFFAOYSA-N |