N-benzyl-3-(2-chlorobenzamido)-N-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
N-benzyl-3-(2-chlorobenzamido)-N-methyl-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
N-benzyl-3-(2-chlorobenzamido)-N-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: | K781-1502 |
| Compound Name: | N-benzyl-3-(2-chlorobenzamido)-N-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: | 567.09 |
| Molecular Formula: | C33 H31 Cl N4 O3 |
| Smiles: | CN(Cc1ccccc1)C(c1ccc(c(c1)NC(c1ccccc1[Cl])=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5027 |
| logD: | 5.2455 |
| logSw: | -5.7011 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.633 |
| InChI Key: | MRZXNEQBHOYLLC-UHFFFAOYSA-N |