N-(3,4-dichlorophenyl)-N'-{[(4,6-dimethylpyrimidin-2-yl)amino](3-nitroanilino)methylidene}urea
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-N'-{[(4,6-dimethylpyrimidin-2-yl)amino](3-nitroanilino)methylidene}urea
N-(3,4-dichlorophenyl)-N'-{[(4,6-dimethylpyrimidin-2-yl)amino](3-nitroanilino)methylidene}urea
Compound characteristics
| Compound ID: | 4477-1526 |
| Compound Name: | N-(3,4-dichlorophenyl)-N'-{[(4,6-dimethylpyrimidin-2-yl)amino](3-nitroanilino)methylidene}urea |
| Molecular Weight: | 474.3 |
| Molecular Formula: | C20 H17 Cl2 N7 O3 |
| Smiles: | Cc1cc(C)nc(NC(\Nc2cccc(c2)[N+]([O-])=O)=N/C(Nc2ccc(c(c2)[Cl])[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0849 |
| logD: | 1.3967 |
| logSw: | -5.4608 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102.441 |
| InChI Key: | GJJISFLFKQCDGD-UHFFFAOYSA-N |