N-(3-bromophenyl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
Chemical Structure Depiction of
N-(3-bromophenyl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
N-(3-bromophenyl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
Compound characteristics
| Compound ID: | C200-1238 |
| Compound Name: | N-(3-bromophenyl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide |
| Molecular Weight: | 478.34 |
| Molecular Formula: | C24 H20 Br N3 O3 |
| Smiles: | CC12CC(c3ccccc3O2)NC(N1c1cccc(c1)C(Nc1cccc(c1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1347 |
| logD: | 5.1336 |
| logSw: | -5.0869 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.168 |
| InChI Key: | IZJRMPXHYFZYSZ-UHFFFAOYSA-N |