Pyrimido(4,5-d)pyrimidin-4(1H)-one, 2,3-dihydro-3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-7-methyl-1-phenyl-2-thioxo-

Base Information

• Chemical Name: Pyrimido(4,5-d)pyrimidin-4(1H)-one, 2,3-dihydro-3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-7-methyl-1-phenyl-2-thioxo-
• CAS No.: 142287-34-1
• Molecular Formula: C26H27ClN6OS
• Molecular Weight: 507.0502
• DSSTox Substance ID: DTXSID10162002
• Wikidata: Q83030500
• Mol file: 142287-34-1.mol

Synonyms:142287-34-1;Pyrimido(4,5-d)pyrimidin-4(1H)-one, 2,3-dihydro-3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-7-methyl-1-phenyl-2-thioxo-;3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-7-methyl-1-phenyl-2-sulfanylidenepyrimido[4,5-d]pyrimidin-4-one;C26H27ClN6OS;DTXSID10162002;OBBCRROUKFAFCR-UHFFFAOYSA-N;LS-136293

Chemical Property of Pyrimido(4,5-d)pyrimidin-4(1H)-one, 2,3-dihydro-3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-7-methyl-1-phenyl-2-thioxo-

Chemical Property:

• Vapor Pressure: 5.18E-18mmHg at 25°C
• Refractive Index: 1.722
• Boiling Point: 673.7 °C at 760 mmHg
• Flash Point: 361.3 °C
• PSA: 91.28000
• Density: 1.41 g/cm³
• LogP: 4.48870
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 506.1655584
• Heavy Atom Count: 35
• Complexity: 743

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=C2C(=N1)N(C(=S)N(C2=O)CCCN3CCN(CC3)C4=CC(=CC=C4)Cl)C5=CC=CC=C5