6-{2-[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-{2-[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione
6-{2-[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 3615-0370 |
| Compound Name: | 6-{2-[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 419.78 |
| Molecular Formula: | C18 H14 Cl N3 O7 |
| Smiles: | COc1cc(c(cc1c1ccc(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)o1)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.617 |
| logD: | 0.5022 |
| logSw: | -4.0944 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.238 |
| InChI Key: | OVHKEVPZSOLSIF-UHFFFAOYSA-N |