N-{(3-chloro-4-methylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-oxobutanamide
Chemical Structure Depiction of
N-{(3-chloro-4-methylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-oxobutanamide
N-{(3-chloro-4-methylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-oxobutanamide
Compound characteristics
| Compound ID: | 4060-0024 |
| Compound Name: | N-{(3-chloro-4-methylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-oxobutanamide |
| Molecular Weight: | 373.84 |
| Molecular Formula: | C18 H20 Cl N5 O2 |
| Smiles: | CC(CC(/N=C(\Nc1ccc(C)c(c1)[Cl])Nc1nc(C)cc(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0356 |
| logD: | -2.0918 |
| logSw: | -3.4478 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.241 |
| InChI Key: | GFSGREBIXIJDTP-UHFFFAOYSA-N |