2'-(2,4-dinitrophenyl)-2',3',4'a,5',8',8'a-hexahydrospiro[cyclopropane-1,9'-[5,8]methanophthalazine]-1',4'-dione
Chemical Structure Depiction of
2'-(2,4-dinitrophenyl)-2',3',4'a,5',8',8'a-hexahydrospiro[cyclopropane-1,9'-[5,8]methanophthalazine]-1',4'-dione
2'-(2,4-dinitrophenyl)-2',3',4'a,5',8',8'a-hexahydrospiro[cyclopropane-1,9'-[5,8]methanophthalazine]-1',4'-dione
Compound characteristics
| Compound ID: | 8007-4332 |
| Compound Name: | 2'-(2,4-dinitrophenyl)-2',3',4'a,5',8',8'a-hexahydrospiro[cyclopropane-1,9'-[5,8]methanophthalazine]-1',4'-dione |
| Molecular Weight: | 370.32 |
| Molecular Formula: | C17 H14 N4 O6 |
| Smiles: | C1CC12C1C=CC2C2C1C(NN(C2=O)c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1406 |
| logD: | -2.2169 |
| logSw: | -2.3136 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.651 |
| InChI Key: | VXATYHIRCKFCEU-UHFFFAOYSA-N |