methyl {1-(3,4-dichlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene}acetate
Chemical Structure Depiction of
methyl {1-(3,4-dichlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene}acetate
methyl {1-(3,4-dichlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene}acetate
Compound characteristics
| Compound ID: | Y020-5336 |
| Compound Name: | methyl {1-(3,4-dichlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene}acetate |
| Molecular Weight: | 420.25 |
| Molecular Formula: | C18 H15 Cl2 N5 O3 |
| Smiles: | Cc1cc(C)nc(NC2=NC(=C\C(=O)OC)\C(N2c2ccc(c(c2)[Cl])[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1191 |
| logD: | 3.0902 |
| logSw: | -3.5372 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.018 |
| InChI Key: | IIBKMBZUENMQNX-UHFFFAOYSA-N |