AC1O4SJH structure

AC1O4SJH

2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide

Also Known As: NCGC00099863-01|AN-919/40868727|SR-01000501977-1|2-{[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide|2-((5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl)thio)-N-(3,4-dimethoxyphenethyl)acetamide|2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide

CAS: 442572-27-2
Molecular Formula C29H30N4O5S
Molecular Weight 546.19366 g/mol
LogP 4.691
Topological Polar Surface Area 104.69 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 12
Exact Mass 546.19366
Monoisotopic Mass 546.19366
Heavy Atoms 39
Complexity 1398.2058

Chemical Identifiers

CAS Number 442572-27-2
SMILES COC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)OC

Product Overview

AC1O4SJH (CAS 442572-27-2), with molecular formula C29H30N4O5S and molecular weight 546.19366 g/mol. IUPAC: 2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]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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