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| CAS No.: | 888719-03-7 |
|---|---|
| Name: | 1-(4-Fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-1,2-dihydro-2-oxo-3-pyridinecarboxamide |
| Molecular Structure: | |
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| Formula: | C25H16F2N4O3 |
| Molecular Weight: | 458.424 |
| Synonyms: | RS0065;3ce3;2-pyridone analogue,2;N-(4-(1H-Pyrrolo[2,3-b]pyridin-4-yloxy)-3-fluorophenyl)-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide; |
| Density: | 1.497 g/cm3 |
| Melting Point: | 212-214 °C |
| Boiling Point: | 701.5 °C at 760 mmHg |
| Flash Point: | 378.1 °C |
| PSA: | 89.01000 |
| LogP: | 5.10960 |
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- Total:11 Page 1 of 1 1
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Specification
1-(4-Fluorophenyl)-N-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-1,2-dihydro-2-oxo-3-pyridinecarboxamide , with CAS registry number 888719-03-7, has other names like N-(4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)-3-fluorophenyl)-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide .
It has the index of refraction 1.72 and molar refractivity 120.95 cm3. And its molar volume is 306 cm3 and polarizability is 47.95 ×10-24cm3. Besides these physical properties, it has surface tension 72.7 dyne/cm, enthalpy of vaporization 102.68 kJ/mol and vapour pressure 1.58E-19 mmHg at 25°C.
You could convert the chemical data into molecular structure through the following chainings:
SMILES:
Fc1ccc(cc1)N2/C=C\C=C(/C2=O)C(=O)Nc5ccc(Oc3ccnc4nccc34)c(F)c5
InChI:
InChI=1/C25H16F2N4O3/c26-15-3-6-17(7-4-15)31-13-1-2-19(25(31)33)24(32)30-16-5-8-22(20(27)14-16)34-21-10-12-29-23-18(21)9-11-28-23/h1-14H,(H,28,29)(H,30,32)