2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-[3-(methylsulfanyl)phenyl]acetamide
2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | E744-0294 |
| Compound Name: | 2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C19 H16 F N7 O2 S |
| Smiles: | CSc1cccc(c1)NC(Cn1c(c(c2nc(c3ccc(cc3)F)no2)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0652 |
| logD: | 3.0652 |
| logSw: | -3.3631 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.752 |
| InChI Key: | UQTCBDZCQYWSAD-UHFFFAOYSA-N |