2,6-difluoro-N-{5-[(2-methoxyphenyl)carbamoyl]-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl}benzamide
Chemical Structure Depiction of
2,6-difluoro-N-{5-[(2-methoxyphenyl)carbamoyl]-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl}benzamide
2,6-difluoro-N-{5-[(2-methoxyphenyl)carbamoyl]-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl}benzamide
Compound characteristics
| Compound ID: | K781-2033 |
| Compound Name: | 2,6-difluoro-N-{5-[(2-methoxyphenyl)carbamoyl]-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl}benzamide |
| Molecular Weight: | 570.6 |
| Molecular Formula: | C32 H28 F2 N4 O4 |
| Smiles: | COc1ccccc1NC(c1ccc(c(c1)NC(c1c(cccc1F)F)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4882 |
| logD: | 3.2802 |
| logSw: | -5.5366 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.506 |
| InChI Key: | XABXSPNEKBOCNQ-UHFFFAOYSA-N |