N-(2,4-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-(2,4-dimethylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(2,4-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: | J021-2200 |
Compound Name: | N-(2,4-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(Nc2ccc(C)cc2C)=O)on1 |
Stereo: | ACHIRAL |
logP: | 2.3158 |
logD: | 1.9813 |
logSw: | -2.7885 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.521 |
InChI Key: | HOCRFRJAMKFCAD-UHFFFAOYSA-N |