2'-(4-ethylpiperazin-1-yl)-2-(2-methoxyanilino)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one
Chemical Structure Depiction of
2'-(4-ethylpiperazin-1-yl)-2-(2-methoxyanilino)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one
2'-(4-ethylpiperazin-1-yl)-2-(2-methoxyanilino)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one
Compound characteristics
Compound ID: | Y020-4064 |
Compound Name: | 2'-(4-ethylpiperazin-1-yl)-2-(2-methoxyanilino)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one |
Molecular Weight: | 421.5 |
Molecular Formula: | C22 H27 N7 O2 |
Smiles: | CCN1CCN(CC1)c1ncc(C2=CC(NC(Nc3ccccc3OC)=N2)=O)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 2.1328 |
logD: | 1.4432 |
logSw: | -2.8566 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.105 |
InChI Key: | YPTYVCXWEJZRLA-UHFFFAOYSA-N |