5-[(4-bromobenzene-1-sulfonyl)methyl]-3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfonyl)methyl]-3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazole
5-[(4-bromobenzene-1-sulfonyl)methyl]-3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0451 |
| Compound Name: | 5-[(4-bromobenzene-1-sulfonyl)methyl]-3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazole |
| Molecular Weight: | 437.31 |
| Molecular Formula: | C18 H17 Br N2 O4 S |
| Smiles: | CC(C)Oc1ccc(cc1)c1nc(CS(c2ccc(cc2)[Br])(=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.8011 |
| logD: | 4.8011 |
| logSw: | -4.5663 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.149 |
| InChI Key: | TZIDEIDQSAQBMN-UHFFFAOYSA-N |