3-(3-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(3-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole
3-(3-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0080 |
| Compound Name: | 3-(3-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole |
| Molecular Weight: | 393.26 |
| Molecular Formula: | C16 H13 Br N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(c2cccc(c2)[Br])no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5712 |
| logD: | 4.5712 |
| logSw: | -4.5079 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.346 |
| InChI Key: | KYRNGCIWZIDZCR-UHFFFAOYSA-N |