N-(2,3-dimethylcyclohexyl)-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(2,3-dimethylcyclohexyl)-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
N-(2,3-dimethylcyclohexyl)-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E019-0165 |
| Compound Name: | N-(2,3-dimethylcyclohexyl)-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)acetamide |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C21 H25 N3 O2 S |
| Smiles: | CC1CCCC(C1C)NC(CN1C(c2c3ccccc3sc2C(C)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7345 |
| logD: | 3.7345 |
| logSw: | -4.1811 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.974 |
| InChI Key: | RXFVJHUDAMBZFS-UHFFFAOYSA-N |