N-[2-(azepan-1-yl)ethyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide
N-[2-(azepan-1-yl)ethyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E860-2715 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]acetamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C23 H30 N6 O S |
| Smiles: | Cc1c2c(c(nn1)SCC(NCCN1CCCCCC1)=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 2.5839 |
| logD: | 1.2907 |
| logSw: | -2.8749 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.371 |
| InChI Key: | HHGMMWIRLKFIHL-UHFFFAOYSA-N |