3-(2H-1,3-benzodioxol-5-yl)-5-({[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-({[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-methyl-4H-1,2,4-triazole
3-(2H-1,3-benzodioxol-5-yl)-5-({[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8963 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-({[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C20 H15 F N4 O2 S2 |
| Smiles: | Cn1c(c2ccc3c(c2)OCO3)nnc1SCc1csc(c2ccc(cc2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0346 |
| logD: | 5.0346 |
| logSw: | -4.8066 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.396 |
| InChI Key: | STXGFILJTJYBTG-UHFFFAOYSA-N |