AC1NQTIC structure

AC1NQTIC

5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: 2-(3,5-Dimethylpiperidin-1-yl)-3-({3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one|5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one

CAS: 7026-72-4
Molecular Formula C28H30N4O3S2
Molecular Weight 534.1759 g/mol
LogP 4.89522
Topological Polar Surface Area 67.15 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 534.1759
Monoisotopic Mass 534.1759
Heavy Atoms 37
Complexity 1454.7689

Chemical Identifiers

CAS Number 7026-72-4
SMILES CC1CC(CN(C1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC5=CC=C(C=C5)OC)C

Product Overview

AC1NQTIC (CAS 7026-72-4), with molecular formula C28H30N4O3S2 and molecular weight 534.1759 g/mol. IUPAC: 5-[[2-(3,5-dimethylpiperidin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one.

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