2-[(5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethan-1-one
					Chemical Structure Depiction of
2-[(5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethan-1-one
			2-[(5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethan-1-one
Compound characteristics
| Compound ID: | G856-2662 | 
| Compound Name: | 2-[(5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethan-1-one | 
| Molecular Weight: | 383.42 | 
| Molecular Formula: | C19 H17 N3 O4 S | 
| Smiles: | Cn1c(COc2ccc3c(c2)OCO3)nnc1SCC(c1ccccc1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 2.391 | 
| logD: | 2.391 | 
| logSw: | -2.8543 | 
| Hydrogen bond acceptors count: | 8 | 
| Polar surface area: | 63.889 | 
| InChI Key: | KWWYKIMPWRWXMC-UHFFFAOYSA-N | 
 
				 
				