4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(pyridin-3-yl)methyl]butanamide
Chemical Structure Depiction of
4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(pyridin-3-yl)methyl]butanamide
4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(pyridin-3-yl)methyl]butanamide
Compound characteristics
| Compound ID: | E019-0931 |
| Compound Name: | 4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(pyridin-3-yl)methyl]butanamide |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C21 H20 N4 O2 S |
| Smiles: | CC1c2c(C(N(CCCC(NCc3cccnc3)=O)N=1)=O)c1ccccc1s2 |
| Stereo: | ACHIRAL |
| logP: | 2.019 |
| logD: | 2.0166 |
| logSw: | -2.078 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.354 |
| InChI Key: | XUHASDCOFYFQIL-UHFFFAOYSA-N |