N-(3-methylbutyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Chemical Structure Depiction of
N-(3-methylbutyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
N-(3-methylbutyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Compound characteristics
| Compound ID: | E019-0998 |
| Compound Name: | N-(3-methylbutyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C20 H25 N3 O2 S |
| Smiles: | CC(C)CCNC(CCCN1C(c2c3ccccc3sc2C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1144 |
| logD: | 3.1144 |
| logSw: | -3.2906 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.95 |
| InChI Key: | DICMBJPBWFKDJC-UHFFFAOYSA-N |