AC1LXGRJ structure

AC1LXGRJ

3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid

Also Known As: A2694/0114716|SR-01000090773-1|(E)-3-(5-((2-imino-4-oxo-3-(thiazol-2-yl)thiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid|3-(5-{(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid|3-(5-{[(5E)-2-IMINO-4-OXO-3-(1,3-THIAZOL-2-YL)-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}FURAN-2-YL)BENZOIC ACID|3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid

CAS: 461663-18-3
Molecular Formula C18H11N3O4S2
Molecular Weight 397.0191 g/mol
LogP 4.15697
Topological Polar Surface Area 107.49 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 397.0191
Monoisotopic Mass 397.0191
Heavy Atoms 27
Complexity 1085.7391

Chemical Identifiers

CAS Number 461663-18-3
SMILES C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)/C=C/3\C(=O)N(C(=N)S3)C4=NC=CS4

Product Overview

AC1LXGRJ (CAS 461663-18-3), with molecular formula C18H11N3O4S2 and molecular weight 397.0191 g/mol. IUPAC: 3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid.

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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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