N-(3-chloro-4-methoxyphenyl)-3-(8-chloro-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-chloro-4-methoxyphenyl)-3-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
N-(3-chloro-4-methoxyphenyl)-3-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
Compound characteristics
| Compound ID: | C200-1247 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-3-(8-chloro-2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide |
| Molecular Weight: | 498.36 |
| Molecular Formula: | C25 H21 Cl2 N3 O4 |
| Smiles: | CC12CC(c3cc(ccc3O2)[Cl])NC(N1c1cccc(c1)C(Nc1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4935 |
| logD: | 5.4913 |
| logSw: | -5.9564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.798 |
| InChI Key: | CYIQFQUGBSBYTJ-UHFFFAOYSA-N |