5-[6-nitro-3-(1H-pyrrol-1-yl)-1-benzothiophen-2-yl]-1,3,4-oxadiazole-2-thiol
Chemical Structure Depiction of
5-[6-nitro-3-(1H-pyrrol-1-yl)-1-benzothiophen-2-yl]-1,3,4-oxadiazole-2-thiol
5-[6-nitro-3-(1H-pyrrol-1-yl)-1-benzothiophen-2-yl]-1,3,4-oxadiazole-2-thiol
Compound characteristics
| Compound ID: | 8019-8372 |
| Compound Name: | 5-[6-nitro-3-(1H-pyrrol-1-yl)-1-benzothiophen-2-yl]-1,3,4-oxadiazole-2-thiol |
| Molecular Weight: | 344.37 |
| Molecular Formula: | C14 H8 N4 O3 S2 |
| Smiles: | c1ccn(c1)c1c2ccc(cc2sc1c1nnc(o1)S)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5902 |
| logD: | 0.7774 |
| logSw: | -3.9767 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.142 |
| InChI Key: | SGGLKFULDWLAEX-UHFFFAOYSA-N |