N-(2-fluorophenyl)-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}acetamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-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}acetamide
N-(2-fluorophenyl)-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}acetamide
Compound characteristics
| Compound ID: | V017-7626 |
| Compound Name: | N-(2-fluorophenyl)-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}acetamide |
| Molecular Weight: | 462.4 |
| Molecular Formula: | C22 H18 F4 N4 O3 |
| Smiles: | CN1C2CN(CC(Nc3ccccc3F)=O)C(C=2C(c2ccccc2C(F)(F)F)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6127 |
| logD: | 2.4299 |
| logSw: | -3.3623 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.954 |
| InChI Key: | KCIBQRJQMTWYNR-LJQANCHMSA-N |