AC1MURUW structure

AC1MURUW

methyl 2-[(8-propyl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanyl]propanoate

Also Known As: methyl 2-((5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)thio)propanoate|methyl 2-[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]propanoate

CAS: 369403-63-4
Molecular Formula C20H23N3O2S2
Molecular Weight 401.12317 g/mol
LogP 4.7244
Topological Polar Surface Area 64.97 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 401.12317
Monoisotopic Mass 401.12317
Heavy Atoms 27
Complexity 1015.5383

Chemical Identifiers

CAS Number 369403-63-4
SMILES CCCC1=NC2=C(C3=C1CCCC3)C4=C(S2)C(=NC=N4)SC(C)C(=O)OC

Product Overview

AC1MURUW (CAS 369403-63-4), with molecular formula C20H23N3O2S2 and molecular weight 401.12317 g/mol. IUPAC: methyl 2-[(8-propyl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanyl]propanoate.

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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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