2-{[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
Chemical Structure Depiction of
2-{[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
2-{[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
Compound characteristics
| Compound ID: | 8415-16675 |
| Compound Name: | 2-{[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid |
| Molecular Weight: | 295.27 |
| Molecular Formula: | C11 H9 N3 O5 S |
| Smiles: | CC(C(O)=O)Sc1nnc(c2ccccc2[N+]([O-])=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1777 |
| logD: | -1.8774 |
| logSw: | -2.1235 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.824 |
| InChI Key: | APSFXVNDHQWMPH-LURJTMIESA-N |