4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(prop-2-en-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(prop-2-en-1-yl)benzene-1-sulfonamide
4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(prop-2-en-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D242-0095 |
| Compound Name: | 4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(prop-2-en-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 494.36 |
| Molecular Formula: | C20 H20 Br N3 O5 S |
| Smiles: | COc1ccc(cc1OC)c1nc(CN(CC=C)S(c2ccc(cc2)[Br])(=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.5587 |
| logD: | 4.5587 |
| logSw: | -4.5399 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.196 |
| InChI Key: | RUJSYOFDDSZFBM-UHFFFAOYSA-N |