4,6-di(methanesulfonyl)-1-nitrohexahydroimidazo[4,5-d]imidazol-2(1H)-one
Chemical Structure Depiction of
4,6-di(methanesulfonyl)-1-nitrohexahydroimidazo[4,5-d]imidazol-2(1H)-one
4,6-di(methanesulfonyl)-1-nitrohexahydroimidazo[4,5-d]imidazol-2(1H)-one
Compound characteristics
| Compound ID: | 4877-0161 |
| Compound Name: | 4,6-di(methanesulfonyl)-1-nitrohexahydroimidazo[4,5-d]imidazol-2(1H)-one |
| Molecular Weight: | 329.31 |
| Molecular Formula: | C6 H11 N5 O7 S2 |
| Smiles: | CS(N1CN(C2C1NC(N2[N+]([O-])=O)=O)S(C)(=O)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -1.5055 |
| logD: | -1.5056 |
| logSw: | -1.7502 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 132.694 |
| InChI Key: | GUHPNZSLRWYWAX-UHFFFAOYSA-N |