3-[[[2-[[(4-Cyanophenyl)amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]pyridin-2-ylamino]propionic acid ethyl ester
Bezeichnung:3-[[[2-[[(4-Cyanophenyl)amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]pyridin-2-ylamino]propionic acid ethyl ester
CAS-Nr211915-84-3
Englisch Name:3-[[[2-[[(4-Cyanophenyl)amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]pyridin-2-ylamino]propionic acid ethyl ester
CBNumberCB72500635
SummenformelC27H26N6O3
Molgewicht482.53
MOL-Datei211915-84-3.mol
3-[[[2-[[(4-Cyanophenyl)amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]pyridin-2-ylamino]propionic acid ethyl ester physikalisch-chemischer Eigenschaften
Schmelzpunkt | 149-151°C |
Siedepunkt | 756.4±60.0 °C(Predicted) |
Dichte | 1.25±0.1 g/cm3(Predicted) |
storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
Löslichkeit | DMSO (Slightly, Sonicated), Methanol (Very Slightly, Sonicated) |
pka | 4.21±0.10(Predicted) |
Aggregatzustand | Solid |
Farbe | White to Pale Beige |
InChIKey | OZBOESGNDSVMDK-UHFFFAOYSA-N |
SMILES | C(OCC)(=O)CCN(C(C1=CC=C2N(C)C(CNC3=CC=C(C#N)C=C3)=NC2=C1)=O)C1=NC=CC=C1 |