AC1LXZTJ structure

AC1LXZTJ

ethyl (E)-2-cyano-3-[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate

Also Known As: (E)-ethyl 2-cyano-3-(2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)acrylate|ethyl (2E)-2-cyano-3-[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate|ethyl (E)-2-cyano-3-[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate

CAS: 799776-74-2
Molecular Formula C21H25N5O3
Molecular Weight 395.19574 g/mol
LogP 1.6149
Topological Polar Surface Area 90.94 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 395.19574
Monoisotopic Mass 395.19574
Heavy Atoms 29
Complexity 1042.6882

Chemical Identifiers

CAS Number 799776-74-2
SMILES CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C(\C#N)/C(=O)OCC

Product Overview

AC1LXZTJ (CAS 799776-74-2), with molecular formula C21H25N5O3 and molecular weight 395.19574 g/mol. IUPAC: ethyl (E)-2-cyano-3-[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate.

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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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