3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-phenylpropanamide
Chemical Structure Depiction of
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-phenylpropanamide
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-phenylpropanamide
Compound characteristics
| Compound ID: | J021-2184 |
| Compound Name: | 3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-phenylpropanamide |
| Molecular Weight: | 358.42 |
| Molecular Formula: | C16 H18 N6 O2 S |
| Smiles: | CCc1nnc([nH]1)SCc1nc(CCC(Nc2ccccc2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.6414 |
| logD: | 1.307 |
| logSw: | -2.2916 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.219 |
| InChI Key: | XDTWVXCHSYHKOQ-UHFFFAOYSA-N |