2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8004-7902 |
| Compound Name: | 2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 394.3 |
| Molecular Formula: | C18 H10 N4 O7 |
| Smiles: | C1=C(C(NC(N1)=O)=O)N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5982 |
| logD: | -0.1373 |
| logSw: | -2.4859 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 117.507 |
| InChI Key: | ZDHROWHFPMWKHG-UHFFFAOYSA-N |