AC1LDEBK structure

AC1LDEBK

N-[5-cyano-7-(2-methoxyethyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-1,3-benzodioxole-5-carboxamide

Also Known As: (E)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)benzo[d][1,3]dioxole-5-carboxamide|N-[(2E)-3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-1,3-benzodioxole-5-carboxamide|N-[3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxidanylidene-dipyrido[3,4-c:1'',2''-f]pyrimidin-2-ylidene]-1,3-benzodioxole-5-carboxamide|N-[3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-2-dipyrido[3,4-c:1'',2''-f]pyrimidinylidene]-1,3-benzodioxole-5-carboxamide|N-[3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxodipyrido[3,4-c:1'',2''-f]pyrimidin-2-ylidene]-1,3-benzodioxole-5-carboxamide|N-[3-cyano-5-keto-1-(2-methoxyethyl)-10-methyl-dipyrido[3,4-c:1'',2''-f]pyrimidin-2-ylidene]-piperonylamide

CAS: 1164528-29-3
Molecular Formula C24H19N5O5
Molecular Weight 457.1386 g/mol
LogP 1.6
Topological Polar Surface Area 117.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 457.1386
Monoisotopic Mass 457.1386
Heavy Atoms 34
Complexity 1170.0

Chemical Identifiers

CAS Number 1164528-29-3
SMILES CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=NC(=O)C4=CC5=C(C=C4)OCO5)N3CCOC)C#N
InChIKey LVIFLDFEQGMDBS-UHFFFAOYSA-N

Product Overview

AC1LDEBK (CAS 1164528-29-3), with molecular formula C24H19N5O5 and molecular weight 457.1386 g/mol. IUPAC: N-[5-cyano-7-(2-methoxyethyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-1,3-benzodioxole-5-carboxamide.

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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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