2-[2,2-dicyano-1-(piperidin-1-yl)ethenyl]-3-(3,4-dimethoxyphenyl)cyclopropane-1,1,2-tricarbonitrile
Chemical Structure Depiction of
2-[2,2-dicyano-1-(piperidin-1-yl)ethenyl]-3-(3,4-dimethoxyphenyl)cyclopropane-1,1,2-tricarbonitrile
2-[2,2-dicyano-1-(piperidin-1-yl)ethenyl]-3-(3,4-dimethoxyphenyl)cyclopropane-1,1,2-tricarbonitrile
Compound characteristics
| Compound ID: | 8020-0568 |
| Compound Name: | 2-[2,2-dicyano-1-(piperidin-1-yl)ethenyl]-3-(3,4-dimethoxyphenyl)cyclopropane-1,1,2-tricarbonitrile |
| Molecular Weight: | 412.45 |
| Molecular Formula: | C23 H20 N6 O2 |
| Smiles: | COc1ccc(cc1OC)C1C(C#N)(C#N)C1(C#N)C(=C(C#N)C#N)N1CCCCC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.008 |
| logD: | 3.008 |
| logSw: | -3.0437 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 103.662 |
| InChI Key: | FIQQPAPVEMDOQH-UHFFFAOYSA-N |