2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(4-ethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(4-ethoxyphenyl)prop-2-enamide
2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(4-ethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 5408-1576 |
| Compound Name: | 2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(4-ethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 386.45 |
| Molecular Formula: | C23 H22 N4 O2 |
| Smiles: | CCOc1ccc(cc1)NC(C(=C/c1cc(C)n(c2cccnc2)c1C)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5569 |
| logD: | 3.5556 |
| logSw: | -3.4871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.692 |
| InChI Key: | AQEIGKRSMZCYIJ-UHFFFAOYSA-N |