N-[(4-ethoxyphenyl)methyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
N-[(4-ethoxyphenyl)methyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E019-0296 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | CCOc1ccc(CNC(CN2C(c3c4ccccc4sc3C(C)=N2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7404 |
| logD: | 3.7404 |
| logSw: | -4.1054 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.982 |
| InChI Key: | VOKWJVFDBWPHOE-UHFFFAOYSA-N |