RefChem:538940 structure

RefChem:538940

6-[(5Z)-5-[[2-(furan-2-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Also Known As: AB00686034-01|(Z)-6-(5-((2-((furan-2-ylmethyl)amino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid|F1423-1297|6-[(5Z)-5-[(2-{[(furan-2-yl)methyl]amino}-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid|6-[(5Z)-5-[[2-(furan-2-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid|6-(5-((2-((Furan-2-ylmethyl)amino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid|6-((5Z)-5-((2-((2-Furylmethyl)amino)-4-oxo-4H-pyrido(1,2-A)pyrimidin-3-Y L)methylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)hexanoic acid|6-[(5Z)-5-({2-[(2-FURYLMETHYL)AMINO]-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-Y L}METHYLENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL]HEXANOIC ACID|6-[(5Z)-5-({2-[(2-FURYLMETHYL)AMINO]-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL}METHYLENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL]HEXANOIC ACID|6-[(5Z)-5-({2-[(furan-2-ylmethyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid|6-[5-({2-[(2-furylmethyl)amino]-4-oxo(5-hydropyridino[1,2-a]pyrimidin-3-yl)}me thylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid|644-444-9

CAS: 617697-35-5
Molecular Formula C23H22N4O5S2
Molecular Weight 498.10315 g/mol
LogP 3.7458
Topological Polar Surface Area 117.15 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 10
Exact Mass 498.10315
Monoisotopic Mass 498.10315
Heavy Atoms 34
Complexity 1316.6417

Chemical Identifiers

CAS Number 617697-35-5
SMILES C1=CC2=NC(=C(C(=O)N2C=C1)/C=C\3/C(=O)N(C(=S)S3)CCCCCC(=O)O)NCC4=CC=CO4

Product Overview

RefChem:538940 (CAS 617697-35-5), with molecular formula C23H22N4O5S2 and molecular weight 498.10315 g/mol. IUPAC: 6-[(5Z)-5-[[2-(furan-2-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.

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