N-benzyl-3-(8-bromo-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-methylbenzamide
Chemical Structure Depiction of
N-benzyl-3-(8-bromo-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-methylbenzamide
N-benzyl-3-(8-bromo-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-methylbenzamide
Compound characteristics
| Compound ID: | C201-0111 |
| Compound Name: | N-benzyl-3-(8-bromo-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-methylbenzamide |
| Molecular Weight: | 506.4 |
| Molecular Formula: | C26 H24 Br N3 O3 |
| Smiles: | CC12CC(c3cc(ccc3O2)[Br])NC(N1c1cccc(c1)C(N(C)Cc1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9155 |
| logD: | 4.9155 |
| logSw: | -4.7615 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.227 |
| InChI Key: | WIOLTXHBPFPWAW-UHFFFAOYSA-N |