4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-(3-methylphenyl)benzamide
Chemical Structure Depiction of
4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-(3-methylphenyl)benzamide
4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-(3-methylphenyl)benzamide
Compound characteristics
| Compound ID: | C432-0256 |
| Compound Name: | 4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-(3-methylphenyl)benzamide |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C25 H22 Cl N3 O3 |
| Smiles: | Cc1cccc(c1)NC(c1ccc(cc1)N1C(NC2CC1(C)Oc1ccc(cc12)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2287 |
| logD: | 5.2286 |
| logSw: | -5.7037 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.168 |
| InChI Key: | DLQMKDYRAYAAHA-UHFFFAOYSA-N |