4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(propan-2-yl)benzene-1-sulfonamide
4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | D242-0094 |
Compound Name: | 4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(propan-2-yl)benzene-1-sulfonamide |
Molecular Weight: | 496.38 |
Molecular Formula: | C20 H22 Br N3 O5 S |
Smiles: | CC(C)N(Cc1nc(c2ccc(c(c2)OC)OC)no1)S(c1ccc(cc1)[Br])(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.7602 |
logD: | 4.7602 |
logSw: | -4.666 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 79 |
InChI Key: | VUGALGGYSJQYDZ-UHFFFAOYSA-N |