4-[(4-{[1-(4-fluorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2,5-dioxoimidazolidin-1-yl)methyl]benzonitrile
Chemical Structure Depiction of
4-[(4-{[1-(4-fluorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2,5-dioxoimidazolidin-1-yl)methyl]benzonitrile
4-[(4-{[1-(4-fluorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2,5-dioxoimidazolidin-1-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | V009-9953 |
| Compound Name: | 4-[(4-{[1-(4-fluorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-2,5-dioxoimidazolidin-1-yl)methyl]benzonitrile |
| Molecular Weight: | 417.4 |
| Molecular Formula: | C22 H16 F N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1c(/C=C2/C(N(Cc3ccc(C#N)cc3)C(N2)=O)=O)c(n(c2ccc(cc2)F)n1)O |
| Stereo: | ACHIRAL |
| logP: | 2.4749 |
| logD: | 1.0826 |
| logSw: | -2.8367 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.576 |
| InChI Key: | LTDNKRJMZSSDPB-UHFFFAOYSA-N |