N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G954-0043 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C25 H22 N4 O4 S2 |
| Smiles: | Cc1c(c2ccc(nn2)SCC(NCc2ccc3c(c2)OCO3)=O)sc(c2cccc(c2)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5762 |
| logD: | 4.5762 |
| logSw: | -4.5406 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.241 |
| InChI Key: | GMSPZDCMPMAEDR-UHFFFAOYSA-N |