N-(4-{[4-(ethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(4-{[4-(ethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-3,4-dimethoxybenzamide
N-(4-{[4-(ethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-3,4-dimethoxybenzamide
Compound characteristics
Compound ID: | G869-0026 |
Compound Name: | N-(4-{[4-(ethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-3,4-dimethoxybenzamide |
Molecular Weight: | 407.47 |
Molecular Formula: | C22 H25 N5 O3 |
Smiles: | CCNc1cc(C)nc(Nc2ccc(cc2)NC(c2ccc(c(c2)OC)OC)=O)n1 |
Stereo: | ACHIRAL |
logP: | 3.566 |
logD: | 3.4277 |
logSw: | -3.6841 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 77.714 |
InChI Key: | XKILHXWRHOTQRZ-UHFFFAOYSA-N |