2-[[1-(1,3-Benzodioxole-5-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione

Base Information

• Chemical Name: 2-[[1-(1,3-Benzodioxole-5-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
• CAS No.: 6238-40-0
• Molecular Formula: C26H22N2O5
• Molecular Weight: 442.5
• DSSTox Substance ID: DTXSID70387496
• Wikidata: Q82181759
• Mol file: 6238-40-0.mol

Synonyms:326007-81-2;3-{[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]methyl}-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaene-2,4-dione;6238-40-0;CBMicro_002609;ChemDiv1_005095;HMS601H13;DTXSID70387496;CCG-4328;SMSF0018468;STK806790;AKOS000527489;CB04194;2-[[1-(1,3-benzodioxole-5-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione;2-((1-(benzo[d][1,3]dioxole-5-carbonyl)piperidin-4-yl)methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione;BIM-0002594.P001;SR-01000445645;SR-01000445645-1;F0818-0051;2-{[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-4-yl]methyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione

Chemical Property of 2-[[1-(1,3-Benzodioxole-5-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione

Chemical Property:

• Vapor Pressure: 3.64E-18mmHg at 25°C
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 442.15287181
• Heavy Atom Count: 33
• Complexity: 764

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC6=C(C=C5)OCO6