AC1O0D4U structure

AC1O0D4U

ethyl 4-[(E)-[2-(3-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Also Known As: ethyl 4-(1-(3-(1H-imidazol-1-yl)propyl)-2-(3-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|ethyl 4-[(E)-[2-(3-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

CAS: 848741-71-9
Molecular Formula C26H27ClN4O5
Molecular Weight 510.167 g/mol
LogP 4.17014
Topological Polar Surface Area 117.52 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 510.167
Monoisotopic Mass 510.167
Heavy Atoms 36
Complexity 1342.3041

Chemical Identifiers

CAS Number 848741-71-9
SMILES CCOC(=O)C1=C(C(=C(N1)C)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC(=CC=C4)Cl)/O)C

Product Overview

AC1O0D4U (CAS 848741-71-9), with molecular formula C26H27ClN4O5 and molecular weight 510.167 g/mol. IUPAC: ethyl 4-[(E)-[2-(3-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-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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