6-(2-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-(2-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione
6-(2-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 3736-0349 |
| Compound Name: | 6-(2-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}ethenyl)-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 429.82 |
| Molecular Formula: | C20 H16 Cl N3 O6 |
| Smiles: | COc1cc(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)ccc1OCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4947 |
| logD: | 0.38 |
| logSw: | -4.0129 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.352 |
| InChI Key: | FSHFPFCUUWYLTP-UHFFFAOYSA-N |