C22H19N5O3 structure

C22H19N5O3

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

Also Known As: (E)-N-(3-cyano-1-isobutyl-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)furan-2-carboxamide|N-[(2E)-3-cyano-10-methyl-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]furan-2-carboxamide

CAS: 577697-94-0
Molecular Formula C22H19N5O3
Molecular Weight 401.1488 g/mol
LogP 2.8194
Topological Polar Surface Area 105.66 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 401.1488
Monoisotopic Mass 401.1488
Heavy Atoms 30
Complexity 1450.9214

Chemical Identifiers

CAS Number 577697-94-0
SMILES CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=NC(=O)C4=CC=CO4)N3CC(C)C)C#N

Product Overview

C22H19N5O3 (CAS 577697-94-0), with molecular formula C22H19N5O3 and molecular weight 401.1488 g/mol. IUPAC: N-[5-cyano-11-methyl-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]furan-2-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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