3-{1-ethyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}-N-(morpholin-4-yl)propanamide
Chemical Structure Depiction of
3-{1-ethyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}-N-(morpholin-4-yl)propanamide
3-{1-ethyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}-N-(morpholin-4-yl)propanamide
Compound characteristics
| Compound ID: | V029-2126 |
| Compound Name: | 3-{1-ethyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl}-N-(morpholin-4-yl)propanamide |
| Molecular Weight: | 481.47 |
| Molecular Formula: | C22 H26 F3 N5 O4 |
| Smiles: | CCN1C2CN(CCC(NN3CCOCC3)=O)C(C=2C(c2ccccc2C(F)(F)F)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8796 |
| logD: | 0.8052 |
| logSw: | -2.414 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.46 |
| InChI Key: | GUSMWRIFZSMKBD-LJQANCHMSA-N |