3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide
3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide
Compound characteristics
Compound ID: | J021-1550 |
Compound Name: | 3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4,6-trimethylphenyl)propanamide |
Molecular Weight: | 421.52 |
Molecular Formula: | C22 H23 N5 O2 S |
Smiles: | Cc1cc(C)c(c(C)c1)NC(CCc1nc(CSc2nc3ccccc3[nH]2)no1)=O |
Stereo: | ACHIRAL |
logP: | 3.5985 |
logD: | 3.502 |
logSw: | -3.7722 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.067 |
InChI Key: | FHFJUAVFUYINEF-UHFFFAOYSA-N |