N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E019-0228 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide |
| Molecular Weight: | 426.58 |
| Molecular Formula: | C23 H30 N4 O2 S |
| Smiles: | CC1CC(C)CN(CCCNC(CN2C(c3c4ccccc4sc3C(C)=N2)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3546 |
| logD: | 0.7498 |
| logSw: | -3.5754 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.549 |
| InChI Key: | AXOAYAFWOFPZFS-UHFFFAOYSA-N |