2-(3,5-dichloroanilino)-4'-methyl-2'-(piperidin-1-yl)[4,5'-bipyrimidin]-6(1H)-one
Chemical Structure Depiction of
2-(3,5-dichloroanilino)-4'-methyl-2'-(piperidin-1-yl)[4,5'-bipyrimidin]-6(1H)-one
2-(3,5-dichloroanilino)-4'-methyl-2'-(piperidin-1-yl)[4,5'-bipyrimidin]-6(1H)-one
Compound characteristics
| Compound ID: | Y020-3993 |
| Compound Name: | 2-(3,5-dichloroanilino)-4'-methyl-2'-(piperidin-1-yl)[4,5'-bipyrimidin]-6(1H)-one |
| Molecular Weight: | 431.32 |
| Molecular Formula: | C20 H20 Cl2 N6 O |
| Smiles: | Cc1c(cnc(n1)N1CCCCC1)C1=CC(NC(Nc2cc(cc(c2)[Cl])[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5124 |
| logD: | 3.9934 |
| logSw: | -4.5426 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.635 |
| InChI Key: | ZZAGVZUWDCNQKG-UHFFFAOYSA-N |