3-(4-methoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-(3,4,5-trimethoxyphenyl)benzamide
Chemical Structure Depiction of
3-(4-methoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-(3,4,5-trimethoxyphenyl)benzamide
3-(4-methoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-(3,4,5-trimethoxyphenyl)benzamide
Compound characteristics
| Compound ID: | K623-0415 |
| Compound Name: | 3-(4-methoxybenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-(3,4,5-trimethoxyphenyl)benzamide |
| Molecular Weight: | 624.69 |
| Molecular Formula: | C35 H36 N4 O7 |
| Smiles: | COc1ccc(cc1)C(Nc1cc(ccc1N1CC2CC(C1)C1=CC=CC(N1C2)=O)C(Nc1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6054 |
| logD: | 4.2931 |
| logSw: | -4.428 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.095 |
| InChI Key: | XOLYXKSTEUJUHL-UHFFFAOYSA-N |