4-butoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzamide
Chemical Structure Depiction of
4-butoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzamide
4-butoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzamide
Compound characteristics
| Compound ID: | G869-0328 |
| Compound Name: | 4-butoxy-N-(4-{[4-(4-methoxyanilino)-6-methylpyrimidin-2-yl]amino}phenyl)benzamide |
| Molecular Weight: | 497.6 |
| Molecular Formula: | C29 H31 N5 O3 |
| Smiles: | CCCCOc1ccc(cc1)C(Nc1ccc(cc1)Nc1nc(C)cc(Nc2ccc(cc2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9288 |
| logD: | 6.079 |
| logSw: | -5.5753 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.195 |
| InChI Key: | QBCCZWPFUFFRBO-UHFFFAOYSA-N |