(2R*)-8-chloro-3-(2,4-dimethoxyphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Chemical Structure Depiction of
(2R*)-8-chloro-3-(2,4-dimethoxyphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
(2R*)-8-chloro-3-(2,4-dimethoxyphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Compound characteristics
| Compound ID: | C269-0047 |
| Compound Name: | (2R*)-8-chloro-3-(2,4-dimethoxyphenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one |
| Molecular Weight: | 374.82 |
| Molecular Formula: | C19 H19 Cl N2 O4 |
| Smiles: | C[C@]12C[C@@H](c3cc(ccc3O2)[Cl])NC(N1c1ccc(cc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.1227 |
| logD: | 4.1227 |
| logSw: | -4.6766 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.95 |
| InChI Key: | NMJFWHJSKKZETL-LIRRHRJNSA-N |