CAS Number586379-66-0
Synonyms3-[3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl]-N,4-dimethylbenzamide; PH 797804; 3-{3-Bromo-4-[(2,4-difluorobenzyl)oxy]-6-methyl-2-oxo-1(2H)-pyridinyl}-N,4-dimethylbenzamide; 3-(3-Bromo-4-((2,4-difluorobenzyl)oxy)-6-methyl-2-oxopyridin-1(2H)-yl)-N,4-dimethylbenzamide; PH-797804
Molecular FormulaC22H19O3N2Br1F2
Molecular Weight477.31
Density1.5±0.1 g/cm3
Boiling Point593.2±50.0 °C at 760 mmHg
Appearancesolid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 586379-66-0 |
| Catalog No. | 2A-1175008 |
| Chinese Name | 3-溴-4-(2,4-二氟苄氧基)-1-[5-[(甲基氨基)羰基]-2-甲基苯基]-6-甲基吡啶-2(1H)-酮 |
| Synonyms | 3-[3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl]-N,4-dimethylbenzamide; PH 797804; 3-{3-Bromo-4-[(2,4-difluorobenzyl)oxy]-6-methyl-2-oxo-1(2H)-pyridinyl}-N,4-dimethylbenzamide; 3-(3-Bromo-4-((2,4-difluorobenzyl)oxy)-6-methyl-2-oxopyridin-1(2H)-yl)-N,4-dimethylbenzamide; PH-797804 |
| Molecular Formula | C22H19O3N2Br1F2 |
| Molecular Weight | 477.31 |
| Density | 1.5±0.1 g/cm3 |
| Boiling Point | 593.2±50.0 °C at 760 mmHg |
| Appearance | solid |
| Storage Condition | -20℃ |
| HTC | 2933399090 |
| PubChem ID | 37641639 |
| MDL Number | MFCD18251426 |
| SMILES | CNC(=O)c1ccc(C)c(-n2c(C)cc(OCc3ccc(F)cc3F)c(Br)c2=O)c1 |
| InChI | InChI=1S/C22H19BrF2N2O3/c1-12-4-5-14(21(28)26-3)9-18(12)27-13(2)8-19(20(23)22(27)29)30-11-15-6-7-16(24)10-17(15)25/h4-10H,11H2,1-3H3,(H,26,28) |
| InChI Key | KCAJXIDMCNPGHZ-UHFFFAOYSA-N |
| Use of | Properties Name ph 797804 Synonym More Synonyms PH-797804 Biological Activity Related Catalog Signaling Pathways >> MAPK/ERK Pathway >> p38 MAPK Research Areas >> Inflammation/Immunology References [2]. Xing L, et al. Structural bioinformatics-based prediction of exceptional selectivity of p38 MAP kinase inhibitor PH-797804. Biochemistry, 2009, 48(27), 6402-6411. Chemical & Physical Properties Molecular Formula C22H19BrF2N2O3 Exact Mass 476.054718 PSA 60.33000 Index of Refraction 1.629 InChIKey KCAJXIDMCNPGHZ-UHFFFAOYSA-N Storage condition -20℃ Safety Information HS Code 2933399090 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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