N-[2-(1H-benzimidazol-2-yl)ethyl]-2-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | L850-1467 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-2-({5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 478.51 |
| Molecular Formula: | C22 H19 F N8 O2 S |
| Smiles: | Cn1c(c2nc(c3ccc(cc3)F)no2)nnc1SCC(NCCc1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8513 |
| logD: | 2.8379 |
| logSw: | -3.3673 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.323 |
| InChI Key: | DSXXIOSUAMRQBS-UHFFFAOYSA-N |