4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[4-(propan-2-yl)phenyl]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-[4-(propan-2-yl)phenyl]benzamide
4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[4-(propan-2-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | C432-0290 |
| Compound Name: | 4-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)-N-[4-(propan-2-yl)phenyl]benzamide |
| Molecular Weight: | 475.97 |
| Molecular Formula: | C27 H26 Cl N3 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(c1ccc(cc1)N1C(NC2CC1(C)Oc1ccc(cc12)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2069 |
| logD: | 6.2068 |
| logSw: | -6.3485 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.168 |
| InChI Key: | NLPSYJQUCYHWJZ-UHFFFAOYSA-N |