5-(3,4-dimethoxyphenyl)-2-{[(3-methyl-4-phenyl-1H-pyrazol-5-yl)amino]methylidene}cyclohexane-1,3-dione
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-2-{[(3-methyl-4-phenyl-1H-pyrazol-5-yl)amino]methylidene}cyclohexane-1,3-dione
5-(3,4-dimethoxyphenyl)-2-{[(3-methyl-4-phenyl-1H-pyrazol-5-yl)amino]methylidene}cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | Y020-7372 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-2-{[(3-methyl-4-phenyl-1H-pyrazol-5-yl)amino]methylidene}cyclohexane-1,3-dione |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C25 H25 N3 O4 |
| Smiles: | Cc1c(c2ccccc2)c(NC=C2C(CC(CC2=O)c2ccc(c(c2)OC)OC)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3958 |
| logD: | 3.0259 |
| logSw: | -3.9083 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.951 |
| InChI Key: | UUJAFNZJTZZHCH-UHFFFAOYSA-N |