2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{[2-(trifluoromethoxy)phenyl]methyl}tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{[2-(trifluoromethoxy)phenyl]methyl}tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{[2-(trifluoromethoxy)phenyl]methyl}tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
| Compound ID: | S296-4074 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{[2-(trifluoromethoxy)phenyl]methyl}tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
| Molecular Weight: | 448.4 |
| Molecular Formula: | C22 H19 F3 N2 O5 |
| Smiles: | C(c1ccccc1OC(F)(F)F)N1C[C@H]2C(N(Cc3ccc4c(c3)OCO4)C([C@H]2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.503 |
| logD: | 3.1697 |
| logSw: | -3.6488 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.596 |
| InChI Key: | DUQHTANBVPPXSZ-IYBDPMFKSA-N |