AC1Q3EEF structure

AC1Q3EEF

3-(dimethylamino)propyl 4-oxo-3-phenylphthalazine-1-carboxylate;hydrochloride

Also Known As: 3,4-Dichloro-5-morpholinopyridazin|1-Phthalazinecarboxylic acid, 4-oxo-3-phenyl-, 3-(dimethylamino)propyl ester, hydrochloride|4-Oxo-3-phenyl-1-phthalazinecarboxylic acid, 3-(dimethylamino)propyl ester, hydrochloride|3-(dimethylamino)propyl 4-oxo-3-phenyl-3,4-dihydrophthalazine-1-carboxylate hydrochloride(1:1)|3-(Dimethylamino)propyl 4-oxo-3-phenyl-3,4-dihydrophthalazine-1-carboxylate hydrochloride|3-(dimethylamino)propyl 4-oxo-3-phenylphthalazine-1-carboxylate hydrochloride|3-(dimethylamino)propyl 4-oxo-3-phenylphthalazine-1-carboxylate,hydrochloride|3-(Dimethylamino)propyl 4-oxo-3-phenyl-3,4-dihydrophthalazine-1-carboxylate--hydrogen chloride (1/1)

CAS: 23959-70-8
Molecular Formula C20H22ClN3O3
Molecular Weight 387.13498 g/mol
LogP 2.916
Topological Polar Surface Area 62.2 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 387.13498
Monoisotopic Mass 387.13498
Heavy Atoms 27
Complexity 540.0

Chemical Identifiers

CAS Number 23959-70-8
SMILES CN(C)CCCOC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3.Cl
InChIKey VYDSKPDPXZUJIJ-UHFFFAOYSA-N

Product Overview

AC1Q3EEF (CAS 23959-70-8), with molecular formula C20H22ClN3O3 and molecular weight 387.13498 g/mol. IUPAC: 3-(dimethylamino)propyl 4-oxo-3-phenylphthalazine-1-carboxylate;hydrochloride.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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