4'-aminodispiro[cyclopentane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile
Chemical Structure Depiction of
4'-aminodispiro[cyclopentane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile
4'-aminodispiro[cyclopentane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile
Compound characteristics
| Compound ID: | 8018-7701 |
| Compound Name: | 4'-aminodispiro[cyclopentane-1,6'-[3]azabicyclo[3.1.0]hex[3]ene-2',2''-[1,3]dioxolane]-1',5'-dicarbonitrile |
| Molecular Weight: | 258.28 |
| Molecular Formula: | C13 H14 N4 O2 |
| Smiles: | C1CCC2(C1)C1(C#N)C(N)=NC3(C12C#N)OCCO3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.5335 |
| logD: | 0.4732 |
| logSw: | -0.1943 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.487 |
| InChI Key: | XRZLTGIMQPYQAP-UHFFFAOYSA-N |