6-(2-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-(2-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione
6-(2-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 3030-5388 |
| Compound Name: | 6-(2-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 347.33 |
| Molecular Formula: | C16 H17 N3 O6 |
| Smiles: | CC(C)Oc1ccc(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.1961 |
| logD: | -0.9187 |
| logSw: | -3.0175 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.927 |
| InChI Key: | GOUZWCXXGIXJNX-UHFFFAOYSA-N |