rel-(3aR,6aR)-5-benzoyl-N~2~-(2,4-dimethylphenyl)-N~3a~,N~3a~-dimethyltetrahydropyrrolo[3,4-c]pyrrole-2,3a(1H,3H)-dicarboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-5-benzoyl-N~2~-(2,4-dimethylphenyl)-N~3a~,N~3a~-dimethyltetrahydropyrrolo[3,4-c]pyrrole-2,3a(1H,3H)-dicarboxamide
rel-(3aR,6aR)-5-benzoyl-N~2~-(2,4-dimethylphenyl)-N~3a~,N~3a~-dimethyltetrahydropyrrolo[3,4-c]pyrrole-2,3a(1H,3H)-dicarboxamide
Compound characteristics
| Compound ID: | S984-1283 |
| Compound Name: | rel-(3aR,6aR)-5-benzoyl-N~2~-(2,4-dimethylphenyl)-N~3a~,N~3a~-dimethyltetrahydropyrrolo[3,4-c]pyrrole-2,3a(1H,3H)-dicarboxamide |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C25 H30 N4 O3 |
| Smiles: | Cc1ccc(c(C)c1)NC(N1C[C@@H]2CN(C[C@@]2(C1)C(N(C)C)=O)C(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3167 |
| logD: | 2.3167 |
| logSw: | -2.9741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.853 |
| InChI Key: | NOXHQKWVZJGYMH-NLFFAJNJSA-N |