N-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)-3-methylbutanamide
N-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | D576-0302 |
| Compound Name: | N-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)-3-methylbutanamide |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C22 H31 N5 O |
| Smiles: | CC(C)CC(Nc1ccc(cc1)Nc1cc(C)nc(NC2CCCCC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3685 |
| logD: | 5.133 |
| logSw: | -5.2698 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.339 |
| InChI Key: | SVSJSEIFKGVLEC-UHFFFAOYSA-N |