AC1M0DFJ structure

AC1M0DFJ

4-(4-methoxyphenyl)-11-methyl-5-(2-morpholin-4-ylethylsulfanyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Also Known As: 3-(4-methoxyphenyl)-7-methyl-2-((2-morpholinoethyl)thio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one|3-(4-methoxyphenyl)-7-methyl-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

CAS: 848670-77-9
Molecular Formula C23H28N4O3S2
Molecular Weight 472.16028 g/mol
LogP 2.868
Topological Polar Surface Area 59.83 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 472.16028
Monoisotopic Mass 472.16028
Heavy Atoms 32
Complexity 1152.7433

Chemical Identifiers

CAS Number 848670-77-9
SMILES CN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCCN4CCOCC4)C5=CC=C(C=C5)OC

Product Overview

AC1M0DFJ (CAS 848670-77-9), with molecular formula C23H28N4O3S2 and molecular weight 472.16028 g/mol. IUPAC: 4-(4-methoxyphenyl)-11-methyl-5-(2-morpholin-4-ylethylsulfanyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-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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