AC1LYVRX structure

AC1LYVRX

11-(4-chlorophenyl)-10-[(2,6-dichlorophenyl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one

Also Known As: 3-(4-chlorophenyl)-2-[(2,6-dichlorobenzyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one|3-(4-chlorophenyl)-2-((2,6-dichlorobenzyl)thio)-6,7-dihydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one|11-(4-chlorophenyl)-10-{[(2,6-dichlorophenyl)methyl]sulfanyl}-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-12-one|2-[(2,6-dichlorophenyl)methylthio]-3-(4-chlorophenyl)-3,5,6,7-tetrahydrocyclop enta[2,1-d]pyrimidino[4,5-b]thiophen-4-one

CAS: 613227-02-4
Molecular Formula C22H15Cl3N2OS2
Molecular Weight 491.96915 g/mol
LogP 7.1884
Topological Polar Surface Area 34.89 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 491.96915
Monoisotopic Mass 491.96915
Heavy Atoms 30
Complexity 1308.9581

Chemical Identifiers

CAS Number 613227-02-4
SMILES C1CC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=C(C=CC=C4Cl)Cl)C5=CC=C(C=C5)Cl

Product Overview

AC1LYVRX (CAS 613227-02-4), with molecular formula C22H15Cl3N2OS2 and molecular weight 491.96915 g/mol. IUPAC: 11-(4-chlorophenyl)-10-[(2,6-dichlorophenyl)methylsulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.

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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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