2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(2-ethylphenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(2-ethylphenyl)prop-2-enamide
2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(2-ethylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 5408-1581 |
| Compound Name: | 2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]-N-(2-ethylphenyl)prop-2-enamide |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C23 H22 N4 O |
| Smiles: | CCc1ccccc1NC(C(=C/c1cc(C)n(c2cccnc2)c1C)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8857 |
| logD: | 3.8848 |
| logSw: | -3.7441 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.871 |
| InChI Key: | CSAUKCUOPMJIJU-UHFFFAOYSA-N |