2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | V028-4371 |
| Compound Name: | 2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide |
| Molecular Weight: | 492.88 |
| Molecular Formula: | C23 H20 Cl F3 N4 O3 |
| Smiles: | CN1C2CN(CC(NCc3cccc(c3)C(F)(F)F)=O)C(C=2C(c2ccccc2[Cl])NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9328 |
| logD: | 2.8899 |
| logSw: | -3.6122 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.974 |
| InChI Key: | SFDCMZSEWMBGAK-HXUWFJFHSA-N |