N-[1-(3,4-dimethylphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[1-(3,4-dimethylphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-fluorobenzamide
N-[1-(3,4-dimethylphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8014-9606 |
| Compound Name: | N-[1-(3,4-dimethylphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-fluorobenzamide |
| Molecular Weight: | 476.39 |
| Molecular Formula: | C22 H16 F4 N4 O4 |
| Smiles: | Cc1ccc(cc1C)N1C2=C(C(NC1=O)=O)C(C(N2)=O)(C(F)(F)F)NC(c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2523 |
| logD: | -1.8055 |
| logSw: | -3.7115 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.602 |
| InChI Key: | ZRXJYFYVSTVGGD-NRFANRHFSA-N |