5-(6-amino-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Chemical Structure Depiction of
5-(6-amino-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
5-(6-amino-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Compound characteristics
| Compound ID: | 8018-2183 |
| Compound Name: | 5-(6-amino-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione |
| Molecular Weight: | 420.31 |
| Molecular Formula: | C17 H11 F3 N6 O4 |
| Smiles: | c1cc(ccc1c1c(C2=C(N)NC(NC2=O)=O)c2C(NC(Nc2[nH]1)=O)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 0.6564 |
| logD: | 0.64 |
| logSw: | -1.8903 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 7 |
| Polar surface area: | 129.766 |
| InChI Key: | DXAMMCMSCYAVRX-UHFFFAOYSA-N |