3-(4-fluorobenzamido)-N-[(2-methoxyphenyl)methyl]-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
3-(4-fluorobenzamido)-N-[(2-methoxyphenyl)methyl]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
3-(4-fluorobenzamido)-N-[(2-methoxyphenyl)methyl]-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: | K623-0545 |
| Compound Name: | 3-(4-fluorobenzamido)-N-[(2-methoxyphenyl)methyl]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide |
| Molecular Weight: | 566.63 |
| Molecular Formula: | C33 H31 F N4 O4 |
| Smiles: | COc1ccccc1CNC(c1ccc(c(c1)NC(c1ccc(cc1)F)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1588 |
| logD: | 4.4396 |
| logSw: | -5.0668 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.526 |
| InChI Key: | KHEKGQVTXDZMKE-UHFFFAOYSA-N |