2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
Chemical Structure Depiction of
2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one
Compound characteristics
| Compound ID: | E019-0601 |
| Compound Name: | 2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-4-methyl[1]benzothieno[2,3-d]pyridazin-1(2H)-one |
| Molecular Weight: | 481.02 |
| Molecular Formula: | C25 H25 Cl N4 O2 S |
| Smiles: | CCC(C(N1CCN(CC1)c1cccc(c1)[Cl])=O)N1C(c2c3ccccc3sc2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2957 |
| logD: | 5.2957 |
| logSw: | -5.9876 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.685 |
| InChI Key: | WUPQQOMDXAGHNT-FQEVSTJZSA-N |