1-(4-fluorobenzene-1-sulfonyl)-4-(2-nitrobenzene-1-sulfonyl)piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-(4-fluorobenzene-1-sulfonyl)-4-(2-nitrobenzene-1-sulfonyl)piperazine--oxalic acid (1/1)
1-(4-fluorobenzene-1-sulfonyl)-4-(2-nitrobenzene-1-sulfonyl)piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4240-0511 |
| Compound Name: | 1-(4-fluorobenzene-1-sulfonyl)-4-(2-nitrobenzene-1-sulfonyl)piperazine--oxalic acid (1/1) |
| Molecular Weight: | 519.48 |
| Molecular Formula: | C16 H16 F N3 O6 S2 |
| Salt: | HOOCCOOH |
| Smiles: | C1CN(CCN1S(c1ccc(cc1)F)(=O)=O)S(c1ccccc1[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0452 |
| logD: | 2.0452 |
| logSw: | -2.399 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 96.549 |
| InChI Key: | AQYJWBWLKKLJFF-UHFFFAOYSA-N |