N-(2-methoxyethyl)-3-methyl-2-{1-methyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}butanamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-3-methyl-2-{1-methyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}butanamide
N-(2-methoxyethyl)-3-methyl-2-{1-methyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}butanamide
Compound characteristics
| Compound ID: | V005-3609 |
| Compound Name: | N-(2-methoxyethyl)-3-methyl-2-{1-methyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}butanamide |
| Molecular Weight: | 468.48 |
| Molecular Formula: | C22 H27 F3 N4 O4 |
| Smiles: | CC(C)C(C(NCCOC)=O)N1CC2=C(C(c3ccccc3C(F)(F)F)NC(N2C)=O)C1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1129 |
| logD: | 1.9301 |
| logSw: | -3.0688 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.769 |
| InChI Key: | IULQTWAMSLVQLG-UHFFFAOYSA-N |