3-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
Chemical Structure Depiction of
3-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
3-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
Compound characteristics
| Compound ID: | 8415-16665 |
| Compound Name: | 3-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid |
| Molecular Weight: | 329.17 |
| Molecular Formula: | C11 H9 Br N2 O3 S |
| Smiles: | C(CSc1nnc(c2ccc(cc2)[Br])o1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3015 |
| logD: | -0.3942 |
| logSw: | -2.4938 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.72 |
| InChI Key: | IYMKAEHFGVOWRH-UHFFFAOYSA-N |