2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-chloro-4-fluorophenyl)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-chloro-4-fluorophenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-chloro-4-fluorophenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
| Compound ID: | S296-4096 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-chloro-4-fluorophenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
| Molecular Weight: | 416.84 |
| Molecular Formula: | C21 H18 Cl F N2 O4 |
| Smiles: | C(c1ccc(cc1[Cl])F)N1C[C@H]2C(N(Cc3ccc4c(c3)OCO4)C([C@H]2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9913 |
| logD: | 2.4935 |
| logSw: | -3.3444 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.572 |
| InChI Key: | KZWANNDIKHKJKH-IYBDPMFKSA-N |