2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | L850-1867 |
| Compound Name: | 2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C22 H22 N6 O2 S |
| Smiles: | Cn1c(c2nc(c3ccccc3)no2)nnc1SCC(NCCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.816 |
| logD: | 3.816 |
| logSw: | -3.8901 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.041 |
| InChI Key: | DMJGTHUBHRWIAR-UHFFFAOYSA-N |