AC1NZGGW structure

AC1NZGGW

1-butan-2-yl-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-one

Also Known As: 1-butan-2-yl-5-[(3-hydroxypropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|(5E)-1-(butan-2-yl)-5-{[(3-hydroxypropyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(5E)-1-butan-2-yl-5-[(3-hydroxypropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|(E)-1-(sec-butyl)-5-(((3-hydroxypropyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

CAS: 577761-45-6
Molecular Formula C12H19N3O3S
Molecular Weight 285.11472 g/mol
LogP 1.38379
Topological Polar Surface Area 90.61 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 285.11472
Monoisotopic Mass 285.11472
Heavy Atoms 19
Complexity 562.31854

Chemical Identifiers

CAS Number 577761-45-6
SMILES CCC(C)N1C(=C(C(=O)NC1=S)C=NCCCO)O

Product Overview

AC1NZGGW (CAS 577761-45-6), with molecular formula C12H19N3O3S and molecular weight 285.11472 g/mol. IUPAC: 1-butan-2-yl-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-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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