N-(2-{2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-(2-{2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide
N-(2-{2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 1548-0696 |
| Compound Name: | N-(2-{2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C23 H22 Cl N5 O3 |
| Smiles: | Cc1c(/C=N/NC(CNC(/C=C/c2ccc(cc2)OC)=O)=O)c(n(c2ccccc2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9241 |
| logD: | 3.9188 |
| logSw: | -4.5873 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.156 |
| InChI Key: | NYQOCCYWCPTXMK-UHFFFAOYSA-N |