6-(2-phenylethyl)-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
6-(2-phenylethyl)-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
6-(2-phenylethyl)-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V006-2280 |
| Compound Name: | 6-(2-phenylethyl)-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 441.45 |
| Molecular Formula: | C24 H22 F3 N3 O2 |
| Smiles: | C=CCN1C2CN(CCc3ccccc3)C(C=2C(c2ccc(cc2)C(F)(F)F)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0704 |
| logD: | 4.0514 |
| logSw: | -4.2862 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.693 |
| InChI Key: | RCOJWZSPVIYPHH-OAQYLSRUSA-N |