N-(5-chloro-2,4-dimethoxyphenyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
N-(5-chloro-2,4-dimethoxyphenyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Compound characteristics
| Compound ID: | E019-0951 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide |
| Molecular Weight: | 471.96 |
| Molecular Formula: | C23 H22 Cl N3 O4 S |
| Smiles: | CC1c2c(C(N(CCCC(Nc3cc(c(cc3OC)OC)[Cl])=O)N=1)=O)c1ccccc1s2 |
| Stereo: | ACHIRAL |
| logP: | 3.8453 |
| logD: | 3.831 |
| logSw: | -4.5403 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.078 |
| InChI Key: | ZXAJKNNOTQFWEM-UHFFFAOYSA-N |