AC1O00GJ structure

AC1O00GJ

methyl 4-[(E)-[1-[3-(diethylamino)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Also Known As: methyl 4-({1-[3-(diethylamino)propyl]-2-(4-fluorophenyl)-4-hydroxy-5-oxo(3-pyr rolin-3-yl)}carbonyl)-3,5-dimethylpyrrole-2-carboxylate|methyl 4-(1-(3-(diethylamino)propyl)-2-(4-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|methyl 4-[(E)-[1-[3-(diethylamino)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

CAS: 797795-47-2
Molecular Formula C26H32FN3O5
Molecular Weight 485.2326 g/mol
LogP 3.71084
Topological Polar Surface Area 102.94 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 9
Exact Mass 485.2326
Monoisotopic Mass 485.2326
Heavy Atoms 35
Complexity 1148.4823

Chemical Identifiers

CAS Number 797795-47-2
SMILES CCN(CC)CCCN1C(/C(=C(/C2=C(NC(=C2C)C(=O)OC)C)\O)/C(=O)C1=O)C3=CC=C(C=C3)F

Product Overview

AC1O00GJ (CAS 797795-47-2), with molecular formula C26H32FN3O5 and molecular weight 485.2326 g/mol. IUPAC: methyl 4-[(E)-[1-[3-(diethylamino)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate.

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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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