N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-6-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-6-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-6-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | D044-0104 |
| Compound Name: | N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-6-yl}-2-(4-methyl-1-oxophthalazin-2(1H)-yl)acetamide |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C26 H29 N7 O3 |
| Smiles: | CC1c2ccccc2C(N(CC(Nc2ccc3c(c2)n(C)c(CN2CCN(CC2)C(C)=O)n3)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.492 |
| logD: | 1.3797 |
| logSw: | -2.4762 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.704 |
| InChI Key: | ZAQPOTZMFGJHBZ-UHFFFAOYSA-N |