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]pyridine-3-carboxamide
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]pyridine-3-carboxamide
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]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K623-0665 |
| 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]pyridine-3-carboxamide |
| Molecular Weight: | 577.66 |
| Molecular Formula: | C34 H32 F N5 O3 |
| Smiles: | CC1CCc2cc(ccc2N1C(c1ccc(c(c1)NC(c1cccnc1)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7773 |
| logD: | 4.5021 |
| logSw: | -4.303 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.252 |
| InChI Key: | WCZQUFSRBPUVLC-UHFFFAOYSA-N |