N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-chloroacetamide
Chemical Structure Depiction of
N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-chloroacetamide
N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-chloroacetamide
Compound characteristics
| Compound ID: | 7591-0601 |
| Compound Name: | N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-chloroacetamide |
| Molecular Weight: | 416.74 |
| Molecular Formula: | C16 H12 Cl F3 N4 O4 |
| Smiles: | C(c1ccccc1)N1C2=C(C(NC1=O)=O)C(C(N2)=O)(C(F)(F)F)NC(C[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4704 |
| logD: | -1.9056 |
| logSw: | -2.0168 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.272 |
| InChI Key: | QAWRQMQWGVSNJG-HNNXBMFYSA-N |