4'-methyl-2'-(4-methylpiperidin-1-yl)-2-(4-phenoxyanilino)[4,5'-bipyrimidin]-6(1H)-one
Chemical Structure Depiction of
4'-methyl-2'-(4-methylpiperidin-1-yl)-2-(4-phenoxyanilino)[4,5'-bipyrimidin]-6(1H)-one
4'-methyl-2'-(4-methylpiperidin-1-yl)-2-(4-phenoxyanilino)[4,5'-bipyrimidin]-6(1H)-one
Compound characteristics
| Compound ID: | Y020-4008 |
| Compound Name: | 4'-methyl-2'-(4-methylpiperidin-1-yl)-2-(4-phenoxyanilino)[4,5'-bipyrimidin]-6(1H)-one |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C27 H28 N6 O2 |
| Smiles: | CC1CCN(CC1)c1ncc(C2=CC(NC(Nc3ccc(cc3)Oc3ccccc3)=N2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0023 |
| logD: | 4.9893 |
| logSw: | -4.4701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.383 |
| InChI Key: | BVCSQDSAUYYPMA-UHFFFAOYSA-N |