2-(4-Benzylpiperidin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine

Base Information

• Chemical Name: 2-(4-Benzylpiperidin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine
• CAS No.: 5749-21-3
• Molecular Formula: C22H23FN6O2
• Molecular Weight: 422.4554
• DSSTox Substance ID: DTXSID90396520
• Wikidata: Q82197277

Synonyms:5749-21-3;DTXSID90396520;STK555368;AKOS002200444;2-(4-benzylpiperidin-1-yl)-N-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine;2-(4-Benzylpiperidin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine

Chemical Property of 2-(4-Benzylpiperidin-1-yl)-N~4~-(3-fluorophenyl)-5-nitropyrimidine-4,6-diamine

Chemical Property:

• Vapor Pressure: 1.62E-15mmHg at 25°C
• Boiling Point: 624.6°Cat760mmHg
• Flash Point: 331.5°C
• Density: 1.359g/cm³
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 422.18665216
• Heavy Atom Count: 31
• Complexity: 579

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1CC2=CC=CC=C2)C3=NC(=C(C(=N3)NC4=CC(=CC=C4)F)[N+](=O)[O-])N

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