N-(3,5-dimethylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(3,5-dimethylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
| Compound ID: | J021-2214 |
| Compound Name: | N-(3,5-dimethylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C18 H22 N6 O2 S |
| Smiles: | CCc1nnc([nH]1)SCc1nc(CCC(Nc2cc(C)cc(C)c2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.5261 |
| logD: | 2.1917 |
| logSw: | -2.6582 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.219 |
| InChI Key: | KXCIFVAMJPKIOW-UHFFFAOYSA-N |