N-[(1RS)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(1RS)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)acetamide
N-[(1RS)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | Y043-4984 |
| Compound Name: | N-[(1RS)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)acetamide |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C24 H27 N5 O4 |
| Smiles: | CC[C@H](C)[C@@H](c1nc2ccccc2[nH]1)NC(CN1C(c2c(C=N1)ccc(c2OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6388 |
| logD: | 2.631 |
| logSw: | -3.1033 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.692 |
| InChI Key: | NATJFQFPHWOFRI-QKKBWIMNSA-N |