7,11-bis(3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione
Chemical Structure Depiction of
7,11-bis(3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione
7,11-bis(3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione
Compound characteristics
| Compound ID: | C195-0009 |
| Compound Name: | 7,11-bis(3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione |
| Molecular Weight: | 470.42 |
| Molecular Formula: | C19 H14 N6 O7 S |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)C1C2(C(c3cccc(c3)[N+]([O-])=O)NC(N1)=S)C(NC(NC2=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5312 |
| logD: | 1.2211 |
| logSw: | -2.4737 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 152.903 |
| InChI Key: | BEWXYLVEEPXAMR-UHFFFAOYSA-N |