2-(3,5-dichloroanilino)-2'-(4-ethylpiperazin-1-yl)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one
Chemical Structure Depiction of
2-(3,5-dichloroanilino)-2'-(4-ethylpiperazin-1-yl)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one
2-(3,5-dichloroanilino)-2'-(4-ethylpiperazin-1-yl)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one
Compound characteristics
| Compound ID: | Y020-4067 |
| Compound Name: | 2-(3,5-dichloroanilino)-2'-(4-ethylpiperazin-1-yl)-4'-methyl[4,5'-bipyrimidin]-6(1H)-one |
| Molecular Weight: | 460.36 |
| Molecular Formula: | C21 H23 Cl2 N7 O |
| Smiles: | CCN1CCN(CC1)c1ncc(C2=CC(NC(Nc3cc(cc(c3)[Cl])[Cl])=N2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6752 |
| logD: | 3.6752 |
| logSw: | -3.8593 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.172 |
| InChI Key: | VNALZMBFUSIKPN-UHFFFAOYSA-N |