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Basic Information
| CAS No.: | 1020315-31-4 |
|---|---|
| Name: | PF-04457845 |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C23H20F3N5O2 |
| Molecular Weight: | 455.439 |
| Synonyms: | PF-04457845;N-Pyridazin-3-yl-4-(3-{[5-(trifluoroMethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxaMide;N-3-Pyridazinyl-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylene]-1-piperidinecarboxamide |
| Density: | 1.389±0.06 g/cm3(Predicted) |
| Boiling Point: | 687.0±55.0 °C(Predicted) |
| PSA: | 83.47000 |
| LogP: | 4.75380 |
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Synthetic route
- 1020327-61-0
phenyl pyridazin-3-ylcarbamate
- 1020325-53-4
2-(3-piperidin-4-ylidenemethyl-phenoxy)-5-trifluoromethyl-pyridine hydrochloride
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 19h; Product distribution / selectivity; | 86% |
| With N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 16h; | 86% |
- 1020325-53-4
2-(3-piperidin-4-ylidenemethyl-phenoxy)-5-trifluoromethyl-pyridine hydrochloride
- 76925-49-0
ethyl pyridazin-3-ylcarbamate
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| With triethylamine In acetonitrile at 180℃; for 0.666667h; Product distribution / selectivity; microwave irradiation; |
- 1020325-30-7
2-[3-(chIoromethyl)phenoxy]-5-(trifluoromethyl)pyridine
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 4 steps 1: 16 h / 130 °C 2: potassium tert-butylate / tetrahydrofuran 3: hydrogenchloride; water / 1,4-dioxane 4: N-ethyl-N,N-diisopropylamine / acetonitrile / 16 h / 20 °C View Scheme |
- 1020325-22-7
[3-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenyl]methanol
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 5 steps 1: thionyl chloride / dichloromethane / 2 h / 20 °C 2: 16 h / 130 °C 3: potassium tert-butylate / tetrahydrofuran 4: hydrogenchloride; water / 1,4-dioxane 5: N-ethyl-N,N-diisopropylamine / acetonitrile / 16 h / 20 °C View Scheme |
- 1020325-38-5
2-[3-(diethoxyphosphorylmethyl)phenoxy]-5-(trifluoromethyl)pyridine
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1: potassium tert-butylate / tetrahydrofuran 2: hydrogenchloride; water / 1,4-dioxane 3: N-ethyl-N,N-diisopropylamine / acetonitrile / 16 h / 20 °C View Scheme |
- 620-24-6
3-Hydroxybenzyl alcohol
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 6 steps 1: potassium carbonate / N,N-dimethyl-formamide / 16 h / 90 - 95 °C 2: thionyl chloride / dichloromethane / 2 h / 20 °C 3: 16 h / 130 °C 4: potassium tert-butylate / tetrahydrofuran 5: hydrogenchloride; water / 1,4-dioxane 6: N-ethyl-N,N-diisopropylamine / acetonitrile / 16 h / 20 °C View Scheme |
- 52334-81-3
2-chloro-5-trifluoromethylpyridine
- 1020315-31-4
PF-04457845
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 6 steps 1: potassium carbonate / N,N-dimethyl-formamide / 16 h / 90 - 95 °C 2: thionyl chloride / dichloromethane / 2 h / 20 °C 3: 16 h / 130 °C 4: potassium tert-butylate / tetrahydrofuran 5: hydrogenchloride; water / 1,4-dioxane 6: N-ethyl-N,N-diisopropylamine / acetonitrile / 16 h / 20 °C View Scheme |
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