AC1NZR6T structure

AC1NZR6T

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

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

CAS: 797795-05-2
Molecular Formula C30H41N3O5
Molecular Weight 523.3046 g/mol
LogP 4.86924
Topological Polar Surface Area 102.94 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 9
Exact Mass 523.3046
Monoisotopic Mass 523.3046
Heavy Atoms 38
Complexity 1229.815

Chemical Identifiers

CAS Number 797795-05-2
SMILES CCN(CC)CCCN1C(/C(=C(/C2=C(NC(=C2C)C(=O)OC)C)\O)/C(=O)C1=O)C3=CC=C(C=C3)C(C)(C)C

Product Overview

AC1NZR6T (CAS 797795-05-2), with molecular formula C30H41N3O5 and molecular weight 523.3046 g/mol. IUPAC: methyl 4-[(E)-[2-(4-tert-butylphenyl)-1-[3-(diethylamino)propyl]-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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