N-(2,4-difluorophenyl)-3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(2,4-difluorophenyl)-3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
Compound ID: | J021-2310 |
Compound Name: | N-(2,4-difluorophenyl)-3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
Molecular Weight: | 429.45 |
Molecular Formula: | C20 H17 F2 N5 O2 S |
Smiles: | Cc1ccc2c(c1)nc([nH]2)SCc1nc(CCC(Nc2ccc(cc2F)F)=O)on1 |
Stereo: | ACHIRAL |
logP: | 3.4608 |
logD: | 3.3845 |
logSw: | -3.7674 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.765 |
InChI Key: | PDBDUHZWVWBSRT-UHFFFAOYSA-N |