2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)-N-{(1S)-2-methyl-1-[1-(propan-2-yl)-1H-benzimidazol-2-yl]propyl}acetamide
Chemical Structure Depiction of
2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)-N-{(1S)-2-methyl-1-[1-(propan-2-yl)-1H-benzimidazol-2-yl]propyl}acetamide
2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)-N-{(1S)-2-methyl-1-[1-(propan-2-yl)-1H-benzimidazol-2-yl]propyl}acetamide
Compound characteristics
| Compound ID: | Y042-7636 |
| Compound Name: | 2-(7,8-dimethoxy-1-oxophthalazin-2(1H)-yl)-N-{(1S)-2-methyl-1-[1-(propan-2-yl)-1H-benzimidazol-2-yl]propyl}acetamide |
| Molecular Weight: | 477.56 |
| Molecular Formula: | C26 H31 N5 O4 |
| Smiles: | CC(C)[C@@H](c1nc2ccccc2n1C(C)C)NC(CN1C(c2c(C=N1)ccc(c2OC)OC)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3111 |
| logD: | 3.3107 |
| logSw: | -3.6308 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.677 |
| InChI Key: | IXAAOXQWGOUVBQ-QHCPKHFHSA-N |