1-Propanone, 1-(3,4-dihydroxy-5-nitrophenyl)-3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)-, dihydrochloride

Base Information

• Chemical Name: 1-Propanone, 1-(3,4-dihydroxy-5-nitrophenyl)-3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)-, dihydrochloride
• CAS No.: 359783-06-5
• Molecular Formula: C20H22Cl2F3N3O5
• Molecular Weight: 512.3
• UNII: 4M39AXR39C
• Wikidata: Q27260062

Synonyms:1-(3,4-dihydroxy-5-nitrophenyl)-3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)-1-propanone hydrochloride;1-(3,4-dihydroxy-5-nitrophenyl)-3-(N-3'-trifluoromethylphenyl)piperazine-1-propanone;BIA 3-335;BIA-3-335;BIA3-335

Chemical Property of 1-Propanone, 1-(3,4-dihydroxy-5-nitrophenyl)-3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)-, dihydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 5
• Exact Mass: 511.0888607
• Heavy Atom Count: 33
• Complexity: 637

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MSDS Files:

Useful:

• Canonical SMILES: C1CN(CCN1CCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])C3=CC=CC(=C3)C(F)(F)F.Cl.Cl

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