5,5-dimethyl-2-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}cyclohexane-1,3-dione
Chemical Structure Depiction of
5,5-dimethyl-2-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}cyclohexane-1,3-dione
5,5-dimethyl-2-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | Y070-0178 |
| Compound Name: | 5,5-dimethyl-2-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}cyclohexane-1,3-dione |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C27 H28 N2 O2 |
| Smiles: | Cc1cc(C)c(c(C)c1)c1c(C=C2C(CC(C)(C)CC2=O)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7523 |
| logD: | 5.7523 |
| logSw: | -5.3697 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.287 |
| InChI Key: | BGGRGNJWEGVYIA-UHFFFAOYSA-N |