N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(4-fluorophenyl)-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-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G954-0312 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({6-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C24 H19 F N4 O3 S2 |
| Smiles: | Cc1c(c2ccc(nn2)SCC(NCc2ccc3c(c2)OCO3)=O)sc(c2ccc(cc2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5623 |
| logD: | 4.5623 |
| logSw: | -4.4217 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.697 |
| InChI Key: | OZHQNKFKQHXJEB-UHFFFAOYSA-N |