N-(4-methylcyclohexyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Chemical Structure Depiction of
N-(4-methylcyclohexyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
N-(4-methylcyclohexyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Compound characteristics
| Compound ID: | E019-1017 |
| Compound Name: | N-(4-methylcyclohexyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide |
| Molecular Weight: | 397.54 |
| Molecular Formula: | C22 H27 N3 O2 S |
| Smiles: | CC1CCC(CC1)NC(CCCN1C(c2c3ccccc3sc2C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3995 |
| logD: | 4.3995 |
| logSw: | -4.304 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.562 |
| InChI Key: | MJNFSSCGBJGATH-UHFFFAOYSA-N |