N-(4-methyl-2-pyridin-2-ylquinolin-6-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide

Update Time: 2025-04-25 16:31:57

	Common Name	N-(4-methyl-2-pyridin-2-ylquinolin-6-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide	English Name	N-(4-methyl-2-pyridin-2-ylquinolin-6-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide
	CAS NO.	N/A	Molecular Weight	437.4
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₄H₁₈F₃N₃O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	N-(4-methyl-2-pyridin-2-ylquinolin-6-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide

Molecular Formula	C24H18F3N3O2
Molecular Weight	437.4
Exact Mass	437.13511131
LogP	4.90
Standard SMILES	Cc1cc(-c2ccccn2)nc2ccc(NC(=O)COc3ccc(C(F)(F)F)cc3)cc12
Canonical SMILES	CC1=CC(=NC2=C1C=C(C=C2)NC(=O)COC3=CC=C(C=C3)C(F)(F)F)C4=CC=CC=N4
Isomeric SMILES	CC1=CC(=NC2=C1C=C(C=C2)NC(=O)COC3=CC=C(C=C3)C(F)(F)F)C4=CC=CC=N4
Standard InChI Identifier	InChI=1S/C24H18F3N3O2/c1-15-12-22(21-4-2-3-11-28-21)30-20-10-7-17(13-19(15)20)29-23(31)14-32-18-8-5-16(6-9-18)24(25,26)27/h2-13H,14H2,1H3,(H,29,31)
Standard InChI Key	AJCYCYZIEFLULZ-UHFFFAOYSA-N
Compound Complexity	624.00
computational chemistry	Hydrogen Bond Acceptor Count：7 Hydrogen Bond Donor Count：1 Rotatable Bond Count：5 Heavy Atom Count：32 Total Chiral Atom Count：0 Defined Chiral Atom Count：0 Undefined Chiral Atom Count：0 Total Chiral Bond Count：0 Defined Chiral Bond Count：0 Undefined Chiral Bond Count：0 Isotope Atom Count：0 Covalent Unit Count：1 Tautomer Count：-1 Monoisotopic Mass：437.13511131