Nebentan structure

Nebentan

(E)-N-[6-methoxy-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-2-phenylethenesulfonamide

Also Known As: Nebentan|Nebentan [INN]|Nebentan potassium|Nebentan free base|YM598 free base|starbld0000878|HE-11|YM598|YM-598|YM598, YM 598, YM598, Nebentan.|J1.616.236A|Ethenesulfonamide, N-[6-methoxy-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-2-phenyl-, (1E)-|(E)-N-[6-methoxy-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-2-phenylethenesulfonamide|(E)-N-(6-methoxy-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl)-2-phenylethenesulfonamide|(E)-N-(6-Methoxy-5-(2-methoxyphenoxy)-2,2'-bipyrimidin-4-yl)-2-phenylethenesulfonamide|(e)-N-[6-methoxy-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-2-phenylethenesulfonamide|(1E)-N-[6-methoxy-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl]-2-phenylethene-1-sulfonamide|(E)-N-[2-(2-Pyrimidinyl)-5-(2-methoxyphenoxy)-6-methoxy-4-pyrimidinyl]-2-phenylethenesulfonamide|(E)-N-[6-Methoxy-5-(2-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl]-2-phenylethenesulfonamide|(E)-N-[6-methoxy-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]-2-phenyl-ethenesulfonamide|(E)-N-[6-Methoxy-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-2-phenylethene-1-sulfonamide

CAS: 403604-85-3
Molecular Formula C24H21N5O5S
Molecular Weight 491.12634 g/mol
LogP 4.1557
Topological Polar Surface Area 125.42 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 9
Exact Mass 491.12634
Monoisotopic Mass 491.12634
Heavy Atoms 35
Complexity 1431.6471

Chemical Identifiers

CAS Number 403604-85-3
SMILES COC1=CC=CC=C1OC2=C(N=C(N=C2OC)C3=NC=CC=N3)NS(=O)(=O)/C=C/C4=CC=CC=C4

Product Overview

Nebentan (CAS 403604-85-3), with molecular formula C24H21N5O5S and molecular weight 491.12634 g/mol. IUPAC: (E)-N-[6-methoxy-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-2-phenylethenesulfonamide.

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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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