3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide
Compound characteristics
| Compound ID: | J021-2239 |
| Compound Name: | 3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C19 H24 N6 O2 S |
| Smiles: | CCc1nnc([nH]1)SCc1nc(CCC(Nc2c(C)cc(C)cc2C)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.3464 |
| logD: | 2.0119 |
| logSw: | -2.6957 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.823 |
| InChI Key: | UQUFRFALUBTPPL-UHFFFAOYSA-N |