N-(4-fluoro-3-nitrophenyl)-3-(4-fluorophenyl)-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-(4-fluoro-3-nitrophenyl)-3-(4-fluorophenyl)-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-7-carboxamide
N-(4-fluoro-3-nitrophenyl)-3-(4-fluorophenyl)-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | F216-0307 |
| Compound Name: | N-(4-fluoro-3-nitrophenyl)-3-(4-fluorophenyl)-5-methyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-7-carboxamide |
| Molecular Weight: | 441.35 |
| Molecular Formula: | C20 H13 F2 N5 O5 |
| Smiles: | Cn1cc(C(Nc2ccc(c(c2)[N+]([O-])=O)F)=O)c2c1C(N(C(N2)=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0085 |
| logD: | 1.3419 |
| logSw: | -2.8048 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.486 |
| InChI Key: | JITCIWHAOIUMOU-UHFFFAOYSA-N |