4-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[(4-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
4-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[(4-methylphenyl)methyl]benzamide
4-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[(4-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | C432-0045 |
| Compound Name: | 4-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[(4-methylphenyl)methyl]benzamide |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C26 H25 N3 O3 |
| Smiles: | Cc1ccc(CNC(c2ccc(cc2)N2C(NC3CC2(C)Oc2ccccc23)=O)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3017 |
| logD: | 4.3017 |
| logSw: | -4.4582 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.49 |
| InChI Key: | AMLDNEPTCICLQD-UHFFFAOYSA-N |