4'-aminodispiro[cyclohexane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile
Chemical Structure Depiction of
4'-aminodispiro[cyclohexane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile
4'-aminodispiro[cyclohexane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile
Compound characteristics
| Compound ID: | 8017-3401 |
| Compound Name: | 4'-aminodispiro[cyclohexane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile |
| Molecular Weight: | 272.3 |
| Molecular Formula: | C14 H16 N4 O2 |
| Smiles: | C1CCC2(CC1)C1(C#N)C(N)=NC3(C12C#N)OCCO3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.0352 |
| logD: | 1.0242 |
| logSw: | -0.9585 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.121 |
| InChI Key: | XDXVEWOTYAXUFQ-UHFFFAOYSA-N |