N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]prop-2-enamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]prop-2-enamide
N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 5408-1575 |
| Compound Name: | N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]prop-2-enamide |
| Molecular Weight: | 376.84 |
| Molecular Formula: | C21 H17 Cl N4 O |
| Smiles: | Cc1cc(/C=C(/C#N)C(Nc2ccc(cc2)[Cl])=O)c(C)n1c1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7826 |
| logD: | 3.7663 |
| logSw: | -4.3409 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.569 |
| InChI Key: | IOZOWUTWYZPKGG-UHFFFAOYSA-N |