2-(2-furyl)-N'-(4-propoxybenzylidene)-4-quinolinecarbohydrazide

Update Time: 2025-04-25 16:57:08

	Common Name	2-(2-furyl)-N'-(4-propoxybenzylidene)-4-quinolinecarbohydrazide	English Name	2-(2-furyl)-N'-(4-propoxybenzylidene)-4-quinolinecarbohydrazide
	CAS NO.	N/A	Molecular Weight	399.4
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₄H₂₁N₃O₃	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	2-(2-furyl)-N'-(4-propoxybenzylidene)-4-quinolinecarbohydrazide

Molecular Formula	C24H21N3O3
Molecular Weight	399.4
Exact Mass	399.15829154
LogP	4.70
Standard SMILES	CCCOc1ccc(C=NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1
Canonical SMILES	CCCOC1=CC=C(C=C1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4
Isomeric SMILES	CCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4
Standard InChI Identifier	InChI=1S/C24H21N3O3/c1-2-13-29-18-11-9-17(10-12-18)16-25-27-24(28)20-15-22(23-8-5-14-30-23)26-21-7-4-3-6-19(20)21/h3-12,14-16H,2,13H2,1H3,(H,27,28)/b25-16+
Standard InChI Key	WCWZDSZBTNRNGD-PCLIKHOPSA-N
Compound Complexity	576.00
computational chemistry	Hydrogen Bond Acceptor Count：5 Hydrogen Bond Donor Count：1 Rotatable Bond Count：7 Heavy Atom Count：30 Total Chiral Atom Count：0 Defined Chiral Atom Count：0 Undefined Chiral Atom Count：0 Total Chiral Bond Count：1 Defined Chiral Bond Count：1 Undefined Chiral Bond Count：0 Isotope Atom Count：0 Covalent Unit Count：1 Tautomer Count：2 Monoisotopic Mass：399.15829154