7,11-bis(4-chloro-3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione
Chemical Structure Depiction of
7,11-bis(4-chloro-3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione
7,11-bis(4-chloro-3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione
Compound characteristics
| Compound ID: | C202-0281 |
| Compound Name: | 7,11-bis(4-chloro-3-nitrophenyl)-9-sulfanylidene-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5-trione |
| Molecular Weight: | 539.31 |
| Molecular Formula: | C19 H12 Cl2 N6 O7 S |
| Smiles: | c1cc(c(cc1C1C2(C(c3ccc(c(c3)[N+]([O-])=O)[Cl])NC(N1)=S)C(NC(NC2=O)=O)=O)[N+]([O-])=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3228 |
| logD: | 2.0126 |
| logSw: | -3.5488 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 152.301 |
| InChI Key: | QANLCIFRKDGWKG-UHFFFAOYSA-N |