N-(4-Chlorophenyl)-6-[[[(4-chlorophenyl)amino]carbonyl]amino]-H-purine-9-carboxamide

Base Information

• Chemical Name: N-(4-Chlorophenyl)-6-[[[(4-chlorophenyl)amino]carbonyl]amino]-H-purine-9-carboxamide
• CAS No.: 1092352-77-6
• Molecular Formula: C19H13Cl2N7O2
• Molecular Weight: 442.26
• DSSTox Substance ID: DTXSID50704440
• Wikidata: Q82636866
• Mol file: 1092352-77-6.mol

Synonyms:1092352-77-6;N-(4-Chlorophenyl)-6-[[[(4-chlorophenyl)amino]carbonyl]amino]-H-purine-9-carboxamide;N-(4-chlorophenyl)-6-[(4-chlorophenyl)carbamoylamino]purine-9-carboxamide;DTXSID50704440;FT-0726941;N-(4-Chlorophenyl)-6-{[(4-chlorophenyl)carbamoyl]amino}-9H-purine-9-carboxamide

Chemical Property of N-(4-Chlorophenyl)-6-[[[(4-chlorophenyl)amino]carbonyl]amino]-H-purine-9-carboxamide

Chemical Property:

• PSA: 117.32000
• LogP: 5.01690
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 441.0507781
• Heavy Atom Count: 30
• Complexity: 612

Purity/Quality:

97% ^*data from raw suppliers

N-(4-CHLOROPHENYL)-6-[[[(4-CHLOROPHENYL)AMINO]CARBONYL]AMINO]-9H-PURINE-9-CARBOXAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC(=O)NC2=C3C(=NC=N2)N(C=N3)C(=O)NC4=CC=C(C=C4)Cl)Cl