N-[3-(8-chloro-3,4-dihydropyrazino[1,2-a]benzimidazol-2(1H)-yl)phenyl]-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(8-chloro-3,4-dihydropyrazino[1,2-a]benzimidazol-2(1H)-yl)phenyl]-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
N-[3-(8-chloro-3,4-dihydropyrazino[1,2-a]benzimidazol-2(1H)-yl)phenyl]-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | D454-0543 |
| Compound Name: | N-[3-(8-chloro-3,4-dihydropyrazino[1,2-a]benzimidazol-2(1H)-yl)phenyl]-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide |
| Molecular Weight: | 498.97 |
| Molecular Formula: | C27 H23 Cl N6 O2 |
| Smiles: | CC1c2ccccc2C(N(CC(Nc2cccc(c2)N2CCn3c4ccc(cc4nc3C2)[Cl])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4698 |
| logD: | 4.4697 |
| logSw: | -4.5836 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.185 |
| InChI Key: | JXPAVVKDIFNKFW-UHFFFAOYSA-N |