AC1LS9Q5 structure

AC1LS9Q5

4-[2-methylsulfanyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide

Also Known As: Oprea1_116076|KS-00003D7S|4-(2-(Methylsulfanyl)-6-(4-phenylpiperazino)-4-pyrimidinyl)tetrahydro-1(2H)-pyrazinecarboxamide|7M-838|4-[2-methylsulfanyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide|4-[2-(methylsulfanyl)-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide|4-[2-(methylsulfanyl)-6-(4-phenylpiperazino)-4-pyrimidinyl]tetrahydro-1(2H)-pyrazinecarboxamide

CAS: 339017-91-3
Molecular Formula C20H27N7OS
Molecular Weight 413.19977 g/mol
LogP 1.7258
Topological Polar Surface Area 81.83 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 413.19977
Monoisotopic Mass 413.19977
Heavy Atoms 29
Complexity 833.9783

Chemical Identifiers

CAS Number 339017-91-3
SMILES CSC1=NC(=CC(=N1)N2CCN(CC2)C(=O)N)N3CCN(CC3)C4=CC=CC=C4

Product Overview

AC1LS9Q5 (CAS 339017-91-3), with molecular formula C20H27N7OS and molecular weight 413.19977 g/mol. IUPAC: 4-[2-methylsulfanyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide.

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