[rel-(3aR,6aR)-5-benzoyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl][4-(methoxymethyl)-5-methyl-1,2-oxazol-3-yl]methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-5-benzoyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl][4-(methoxymethyl)-5-methyl-1,2-oxazol-3-yl]methanone
[rel-(3aR,6aR)-5-benzoyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl][4-(methoxymethyl)-5-methyl-1,2-oxazol-3-yl]methanone
Compound characteristics
| Compound ID: | S986-0412 |
| Compound Name: | [rel-(3aR,6aR)-5-benzoyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl][4-(methoxymethyl)-5-methyl-1,2-oxazol-3-yl]methanone |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C23 H30 N4 O4 |
| Smiles: | Cc1c(COC)c(C(N2C[C@H]3CN(C[C@@]3(CN(C)C)C2)C(c2ccccc2)=O)=O)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7669 |
| logD: | -2.2913 |
| logSw: | -1.3428 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.272 |
| InChI Key: | WGGYYGDXPLWKSC-WZONZLPQSA-N |