N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | D305-0035 |
| Compound Name: | N-{1-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C25 H29 N7 O2 |
| Smiles: | CC1c2ccccc2C(N(CC(Nc2ccc3c(c2)nc(CN2CCN(C)CC2)n3C)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5256 |
| logD: | 0.5546 |
| logSw: | -2.5464 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.985 |
| InChI Key: | PUDMNMWIUVCIOD-UHFFFAOYSA-N |