N-[4-(azepane-1-sulfonyl)phenyl]-3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-[4-(azepane-1-sulfonyl)phenyl]-3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0740 |
| Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C24 H33 N7 O3 S |
| Smiles: | CCN(CC)c1ccc2nnc(CCC(Nc3ccc(cc3)S(N3CCCCCC3)(=O)=O)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7594 |
| logD: | 2.7584 |
| logSw: | -3.36 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.764 |
| InChI Key: | ZUDNRNXNXFIXJV-UHFFFAOYSA-N |