N-[5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]pyridine-4-carboxamide
N-[5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | K623-0549 |
| Compound Name: | N-[5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]pyridine-4-carboxamide |
| Molecular Weight: | 549.63 |
| Molecular Formula: | C32 H31 N5 O4 |
| Smiles: | COc1ccccc1CNC(c1ccc(c(c1)NC(c1ccncc1)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8807 |
| logD: | 3.3244 |
| logSw: | -4.031 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.954 |
| InChI Key: | LDACDRRWABMZOC-UHFFFAOYSA-N |