3-(2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
Chemical Structure Depiction of
3-(2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
3-(2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | C326-0379 |
| Compound Name: | 3-(2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide |
| Molecular Weight: | 520.61 |
| Molecular Formula: | C27 H28 N4 O5 S |
| Smiles: | Cc1ccc2c(c1)C1CC(C)(N(C(N1)=O)c1cccc(c1)C(NCCc1ccc(cc1)S(N)(=O)=O)=O)O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6865 |
| logD: | 2.6858 |
| logSw: | -3.3337 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 107.935 |
| InChI Key: | UFIIJXJDIWNHHH-UHFFFAOYSA-N |