2-amino-6-[4-(benzyloxy)phenyl]-4,4-bis(propylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Chemical Structure Depiction of
2-amino-6-[4-(benzyloxy)phenyl]-4,4-bis(propylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
2-amino-6-[4-(benzyloxy)phenyl]-4,4-bis(propylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 6234-0303 |
| Compound Name: | 2-amino-6-[4-(benzyloxy)phenyl]-4,4-bis(propylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile |
| Molecular Weight: | 476.66 |
| Molecular Formula: | C26 H28 N4 O S2 |
| Smiles: | CCCSC1(C2(C#N)C(c3ccc(cc3)OCc3ccccc3)C2(C#N)C(N)=N1)SCCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9087 |
| logD: | 3.3266 |
| logSw: | -5.709 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.886 |
| InChI Key: | ACJLDQASHGHCPL-UHFFFAOYSA-N |