7,11-bis(4-nitrophenyl)-3,9-bis(sulfanylidene)-2,4,8,10-tetraazaspiro[5.5]undecane-1,5-dione
Chemical Structure Depiction of
7,11-bis(4-nitrophenyl)-3,9-bis(sulfanylidene)-2,4,8,10-tetraazaspiro[5.5]undecane-1,5-dione
7,11-bis(4-nitrophenyl)-3,9-bis(sulfanylidene)-2,4,8,10-tetraazaspiro[5.5]undecane-1,5-dione
Compound characteristics
| Compound ID: | C202-0317 |
| Compound Name: | 7,11-bis(4-nitrophenyl)-3,9-bis(sulfanylidene)-2,4,8,10-tetraazaspiro[5.5]undecane-1,5-dione |
| Molecular Weight: | 486.48 |
| Molecular Formula: | C19 H14 N6 O6 S2 |
| Smiles: | c1cc(ccc1C1C2(C(c3ccc(cc3)[N+]([O-])=O)NC(N1)=S)C(NC(NC2=O)=S)=O)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5361 |
| logD: | 1.3904 |
| logSw: | -2.9763 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 139.885 |
| InChI Key: | BPGRWHROPUQIKW-UHFFFAOYSA-N |