N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G954-0177 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C22 H18 N4 O3 S3 |
| Smiles: | Cc1c(c2ccc(nn2)SCC(NCc2ccc3c(c2)OCO3)=O)sc(c2cccs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3846 |
| logD: | 4.3846 |
| logSw: | -4.3286 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.715 |
| InChI Key: | BFYNATQGTJWVLT-UHFFFAOYSA-N |