Ethyl 4-[2-[(4-Ethoxyphenyl)amino]-2-oxoethoxy]-1,6-dihydro-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic Acid Ester - CAS 899729-77-2

Catalog:	BB065726
Product Name:	Ethyl 4-[2-[(4-Ethoxyphenyl)amino]-2-oxoethoxy]-1,6-dihydro-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic Acid Ester
CAS:	899729-77-2
Synonyms:	ethyl 4-(2-((4-ethoxyphenyl)amino)-2-oxoethoxy)-6-oxo-1-(p-tolyl)-1,6-dihydropyridazine-3-carboxylate; ethyl 4-{[(4-ethoxyphenyl)carbamoyl]methoxy}-1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazine-3-carboxylate; ethyl 4-[2-(4-ethoxyanilino)-2-oxoethoxy]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate; ethyl4-(2-((4-ethoxyphenyl)amino)-2-oxoethoxy)-6-oxo-1-(p-tolyl)-1,6-dihydropyridazine-3-carboxylate

Technical Data

IUPAC Name:	ethyl 4-[2-(4-ethoxyanilino)-2-oxoethoxy]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate
Molecular Weight:	451.47
Molecular Formula:	C24H25N3O6
Canonical SMILES:	CCOC1=CC=C(C=C1)NC(=O)COC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C
InChI:	InChI=1S/C24H25N3O6/c1-4-31-19-12-8-17(9-13-19)25-21(28)15-33-20-14-22(29)27(18-10-6-16(3)7-11-18)26-23(20)24(30)32-5-2/h6-14H,4-5,15H2,1-3H3,(H,25,28)
InChI Key:	QCCFMEHUMUMRHR-UHFFFAOYSA-N

Complexity:	764
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	451.17433553
Formal Charge:	0
Heavy Atom Count:	33
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	451.17433553
Rotatable Bond Count:	10
Topological Polar Surface Area:	107Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5