phenyl {[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
phenyl {[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
phenyl {[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D394-6005 |
| Compound Name: | phenyl {[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate |
| Molecular Weight: | 357.34 |
| Molecular Formula: | C16 H11 N3 O5 S |
| Smiles: | C(C(=O)Oc1ccccc1)Sc1nnc(c2ccc(cc2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2532 |
| logD: | 3.2532 |
| logSw: | -3.6724 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.5 |
| InChI Key: | GKNACAPDQLJXQE-UHFFFAOYSA-N |