N-[5-(6-fluoro-2-methyl-3,4-dihydroquinoline-1(2H)-carbonyl)-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[5-(6-fluoro-2-methyl-3,4-dihydroquinoline-1(2H)-carbonyl)-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]-3,4,5-trimethoxybenzamide
N-[5-(6-fluoro-2-methyl-3,4-dihydroquinoline-1(2H)-carbonyl)-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | K623-0663 |
| Compound Name: | N-[5-(6-fluoro-2-methyl-3,4-dihydroquinoline-1(2H)-carbonyl)-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 666.75 |
| Molecular Formula: | C38 H39 F N4 O6 |
| Smiles: | CC1CCc2cc(ccc2N1C(c1ccc(c(c1)NC(c1cc(c(c(c1)OC)OC)OC)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7462 |
| logD: | 5.7409 |
| logSw: | -5.4615 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.712 |
| InChI Key: | JLXPLVVMSCHZKE-UHFFFAOYSA-N |