N~1~,N~4~-bis(4-nitrophenyl)piperazine-1,4-dicarbothioamide
Chemical Structure Depiction of
N~1~,N~4~-bis(4-nitrophenyl)piperazine-1,4-dicarbothioamide
N~1~,N~4~-bis(4-nitrophenyl)piperazine-1,4-dicarbothioamide
Compound characteristics
| Compound ID: | Y502-3746 |
| Compound Name: | N~1~,N~4~-bis(4-nitrophenyl)piperazine-1,4-dicarbothioamide |
| Molecular Weight: | 446.5 |
| Molecular Formula: | C18 H18 N6 O4 S2 |
| Smiles: | C1CN(CCN1C(Nc1ccc(cc1)[N+]([O-])=O)=S)C(Nc1ccc(cc1)[N+]([O-])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.9928 |
| logD: | 3.9928 |
| logSw: | -4.2045 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.606 |
| InChI Key: | VDPAFJBDMPTXLB-UHFFFAOYSA-N |