1H-Pyrrole-2-acetamide, 1-methyl-5-(4-methylbenzoyl)-N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-

Base Information

• Chemical Name: 1H-Pyrrole-2-acetamide, 1-methyl-5-(4-methylbenzoyl)-N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-
• CAS No.: 98617-19-7
• Molecular Formula: C24H26N6O4
• Molecular Weight: 462.501
• DSSTox Substance ID: DTXSID40243737
• Wikidata: Q83127889

Synonyms:1H-Pyrrole-2-acetamide, 1-methyl-5-(4-methylbenzoyl)-N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-;98617-19-7;7-(1-Methyl-5-p-methylbenzoylpyrrole-2-acetamidoethyl)theophylline;DTXSID40243737;LS-136533

Chemical Property of 1H-Pyrrole-2-acetamide, 1-methyl-5-(4-methylbenzoyl)-N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-

Chemical Property:

• Density: 1.34g/cm³
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 462.20155333
• Heavy Atom Count: 34
• Complexity: 813

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)NCCN3C=NC4=C3C(=O)N(C(=O)N4C)C

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