2-[3-(2-chlorophenyl)-4-methyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one
					Chemical Structure Depiction of
2-[3-(2-chlorophenyl)-4-methyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one
			2-[3-(2-chlorophenyl)-4-methyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one
Compound characteristics
| Compound ID: | 8008-9169 | 
| Compound Name: | 2-[3-(2-chlorophenyl)-4-methyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one | 
| Molecular Weight: | 351.81 | 
| Molecular Formula: | C15 H14 Cl N3 O3 S | 
| Smiles: | CN1C(c2ccccc2[Cl])=NN(C2CC(C3OCC2O3)=O)C1=S | 
| Stereo: | MIXTURE OF STEREOISOMERS | 
| logP: | 1.8846 | 
| logD: | 1.8846 | 
| logSw: | -3.0166 | 
| Hydrogen bond acceptors count: | 7 | 
| Polar surface area: | 47.613 | 
| InChI Key: | NCWGORBIKXKLEE-UHFFFAOYSA-N | 
 
				 
				