1,4-bis[2-chloro-5-(ethenesulfinyl)-4-nitrothiophen-3-yl]piperazine
Chemical Structure Depiction of
1,4-bis[2-chloro-5-(ethenesulfinyl)-4-nitrothiophen-3-yl]piperazine
1,4-bis[2-chloro-5-(ethenesulfinyl)-4-nitrothiophen-3-yl]piperazine
Compound characteristics
| Compound ID: | 4872-0527 |
| Compound Name: | 1,4-bis[2-chloro-5-(ethenesulfinyl)-4-nitrothiophen-3-yl]piperazine |
| Molecular Weight: | 557.47 |
| Molecular Formula: | C16 H14 Cl2 N4 O6 S4 |
| Smiles: | C=CS(c1c(c(c(s1)[Cl])N1CCN(CC1)c1c(c(sc1[Cl])S(C=C)=O)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3879 |
| logD: | 5.3879 |
| logSw: | -5.9849 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 104.168 |
| InChI Key: | SLMMBHAELFCCNR-UHFFFAOYSA-N |