N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)butanamide
Chemical Structure Depiction of
N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)butanamide
N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)butanamide
Compound characteristics
| Compound ID: | D576-0239 |
| Compound Name: | N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)butanamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C22 H25 N5 O |
| Smiles: | CCCC(Nc1ccc(cc1)Nc1cc(C)nc(Nc2ccc(C)cc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2927 |
| logD: | 4.4429 |
| logSw: | -5.2008 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 61.292 |
| InChI Key: | WVUQUJHWFLWEFF-UHFFFAOYSA-N |