4-amino-6-(4-ethoxy-3-methoxyphenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Chemical Structure Depiction of
4-amino-6-(4-ethoxy-3-methoxyphenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
4-amino-6-(4-ethoxy-3-methoxyphenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8018-3999 |
| Compound Name: | 4-amino-6-(4-ethoxy-3-methoxyphenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile |
| Molecular Weight: | 354.36 |
| Molecular Formula: | C18 H18 N4 O4 |
| Smiles: | CCOc1ccc(cc1OC)C1C2(C#N)C(N)=NC3(C12C#N)OCCO3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.2976 |
| logD: | -1.8768 |
| logSw: | -1.9536 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.769 |
| InChI Key: | YMUZGCMAYSHVAT-UHFFFAOYSA-N |