AC1M0BEI structure

AC1M0BEI

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]-3,4-dimethylbenzamide

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)-3,4-dimethylbenzamide|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]-3,4-dimethylbenzamide

CAS: 845903-22-2
Molecular Formula C25H23N5O3
Molecular Weight 441.18008 g/mol
LogP 2.83364
Topological Polar Surface Area 101.75 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 441.18008
Monoisotopic Mass 441.18008
Heavy Atoms 33
Complexity 1588.7435

Chemical Identifiers

CAS Number 845903-22-2
SMILES CC1=C(C=C(C=C1)C(=O)N=C2C(=CC3=C(N2CCOC)N=C4C(=CC=CN4C3=O)C)C#N)C

Product Overview

AC1M0BEI (CAS 845903-22-2), with molecular formula C25H23N5O3 and molecular weight 441.18008 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]-3,4-dimethylbenzamide.

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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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