4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide
4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D242-0092 |
| Compound Name: | 4-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzene-1-sulfonamide |
| Molecular Weight: | 454.3 |
| Molecular Formula: | C17 H16 Br N3 O5 S |
| Smiles: | COc1ccc(cc1OC)c1nc(CNS(c2ccc(cc2)[Br])(=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.8872 |
| logD: | 3.8152 |
| logSw: | -4.1665 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.601 |
| InChI Key: | GRRUCEGDLYOURH-UHFFFAOYSA-N |