N-(4-{4-[6-(azepan-1-yl)pyridazin-3-yl]piperazine-1-sulfonyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{4-[6-(azepan-1-yl)pyridazin-3-yl]piperazine-1-sulfonyl}phenyl)acetamide
N-(4-{4-[6-(azepan-1-yl)pyridazin-3-yl]piperazine-1-sulfonyl}phenyl)acetamide
Compound characteristics
| Compound ID: | G856-8672 |
| Compound Name: | N-(4-{4-[6-(azepan-1-yl)pyridazin-3-yl]piperazine-1-sulfonyl}phenyl)acetamide |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C22 H30 N6 O3 S |
| Smiles: | CC(Nc1ccc(cc1)S(N1CCN(CC1)c1ccc(nn1)N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.992 |
| logD: | 2.9789 |
| logSw: | -3.4683 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.925 |
| InChI Key: | SHMUBJYKPPQQEP-UHFFFAOYSA-N |