7-(3-ethoxypropyl)-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonan-2-one
Chemical Structure Depiction of
7-(3-ethoxypropyl)-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonan-2-one
7-(3-ethoxypropyl)-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonan-2-one
Compound characteristics
| Compound ID: | S400-0010 |
| Compound Name: | 7-(3-ethoxypropyl)-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonan-2-one |
| Molecular Weight: | 316.31 |
| Molecular Formula: | C12 H20 N4 O6 |
| Smiles: | CCOCCCN1CC2(CC(C1)(C(NC2)=O)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.209 |
| logD: | 0.2037 |
| logSw: | -0.9581 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.543 |
| InChI Key: | UTJIWXFPRDMVEP-UHFFFAOYSA-N |