1-[2-(2-chlorophenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(2-chlorophenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[2-(2-chlorophenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | F076-1366 |
| Compound Name: | 1-[2-(2-chlorophenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 489.98 |
| Molecular Formula: | C25 H20 Cl N5 O2 S |
| Smiles: | CC(N1C(c2ccccc2[Cl])OC(CSc2nnc(c3ccccc3)n2c2ccccc2)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5001 |
| logD: | 5.4999 |
| logSw: | -5.8515 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.143 |
| InChI Key: | VIHDMULAVUSVOJ-DEOSSOPVSA-N |