N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}-2,2-dimethylpropanamide
Chemical Structure Depiction of
N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}-2,2-dimethylpropanamide
N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | 6165-0206 |
| Compound Name: | N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}-2,2-dimethylpropanamide |
| Molecular Weight: | 498.46 |
| Molecular Formula: | C22 H25 F3 N4 O6 |
| Smiles: | CC(C)(C)C(NC1(C2=C(NC1=O)N(CCc1ccc(c(c1)OC)OC)C(NC2=O)=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8912 |
| logD: | -0.612 |
| logSw: | -2.6191 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.724 |
| InChI Key: | DEDOBTBTAFYHMF-NRFANRHFSA-N |