N-(2,6-difluorophenyl)-3-(3-{[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(2,6-difluorophenyl)-3-(3-{[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(2,6-difluorophenyl)-3-(3-{[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
Compound ID: | J021-3424 |
Compound Name: | N-(2,6-difluorophenyl)-3-(3-{[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
Molecular Weight: | 443.47 |
Molecular Formula: | C21 H19 F2 N5 O2 S |
Smiles: | Cc1cc2c(cc1C)[nH]c(n2)SCc1nc(CCC(Nc2c(cccc2F)F)=O)on1 |
Stereo: | ACHIRAL |
logP: | 4.283 |
logD: | 4.1105 |
logSw: | -4.3628 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.067 |
InChI Key: | HVSIHDODFUSDRX-UHFFFAOYSA-N |