AC1LYAIK structure

AC1LYAIK

N-[4-(dimethylamino)phenyl]-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide

Also Known As: N-[4-(dimethylamino)phenyl]-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide|N-(4-(dimethylamino)phenyl)-2-((3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide|N-(4-dimethylaminophenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide|N-[4-(dimethylamino)phenyl]-2-[3-(4-ethoxyphenyl)-4-oxo(3,5,6,7,8-pentahydrobe nzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio)]acetamide|N-[4-(dimethylamino)phenyl]-2-{[4-(4-ethoxyphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}acetamide

CAS: 613226-67-8
Molecular Formula C28H30N4O3S2
Molecular Weight 534.1759 g/mol
LogP 5.5215
Topological Polar Surface Area 76.46 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 534.1759
Monoisotopic Mass 534.1759
Heavy Atoms 37
Complexity 1474.8324

Chemical Identifiers

CAS Number 613226-67-8
SMILES CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=C(C=C4)N(C)C)SC5=C3CCCC5

Product Overview

AC1LYAIK (CAS 613226-67-8), with molecular formula C28H30N4O3S2 and molecular weight 534.1759 g/mol. IUPAC: N-[4-(dimethylamino)phenyl]-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide.

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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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