Synthesis of imidazo[1,2-a]pyridine-containing peptidomimetics by tandem of Groebke–Blackburn–Bienaymé and Ugi reactions

Oleksandr V. Kolomiiets, Alexander V. Tsygankov, Maryna N. Kornet, Aleksander A. Brazhko, Vladimir I. Musatov and Valentyn A. Chebanov

Beilstein J. Org. Chem. 2023, 19, 727–735. https://doi.org/10.3762/bjoc.19.53

Downloads

Figure 2

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₉H₂₄N₂O₂
Molecular Weight	312.41 g/mol
Exact Mass	312.1838 Da
InChI	InChI=1S/C19H24N2O2/c22-17-12-16(18(23)14-7-2-1-3-8-14)20-19-15-9-5-4-6-13(15)10-11-21(17)19/h4-6,9,14,16,19-20H,1-3,7-8,10-12H2
InChIKey	BYVOCEMYGMNXRA-UHFFFAOYSA-N
SMILES	C1CCC(CC1)C(=O)C2CC(=O)N3CCC4=C(C=CC=C4)C3N2
Number of Atoms	47
Number of H-Bond Acceptors	4
Number of H-Bond Donors	1
Atoms in the Largest π-System	6
XLogP	1.9

Operator	Resulting query
aromatic	the word “aromatic”
aromatic aldehyde	the word “aromatic” OR “aldehyde”
+aromatic +aldehyde	both words “aromatic” AND “aldehyde”
+aromatic -aldehyde	the word “aromatic” but NOT “aldehyde”
“aromatic aldehyde”	the exact phrase “aromatic aldehyde”
benz*	words which begin with “benz”, such as “benzene” or “benzyl”
benz*yl	words that begin with “benz” and end with “yl”, such as “benzyl” or “benzoyl”
benzyl~	words that are close to the word “benzyl”, such as “benzoyl” (i.e., fuzzy search)