4-(3,5-dimethoxyphenyl)-1-methyl-6-{[3-(trifluoromethyl)phenyl]methyl}-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
4-(3,5-dimethoxyphenyl)-1-methyl-6-{[3-(trifluoromethyl)phenyl]methyl}-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
4-(3,5-dimethoxyphenyl)-1-methyl-6-{[3-(trifluoromethyl)phenyl]methyl}-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V008-2011 |
| Compound Name: | 4-(3,5-dimethoxyphenyl)-1-methyl-6-{[3-(trifluoromethyl)phenyl]methyl}-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 461.44 |
| Molecular Formula: | C23 H22 F3 N3 O4 |
| Smiles: | CN1C2CN(Cc3cccc(c3)C(F)(F)F)C(C=2C(c2cc(cc(c2)OC)OC)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9536 |
| logD: | 2.9492 |
| logSw: | -3.5063 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.59 |
| InChI Key: | HPJKYAMYGHXZPA-HXUWFJFHSA-N |