(5E)-5-{[(3,4-dichlorophenyl)carbamoyl]imino}-3-(2-phenylethyl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide

Base Information

• Chemical Name: (5E)-5-{[(3,4-dichlorophenyl)carbamoyl]imino}-3-(2-phenylethyl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
• CAS No.: 67629-52-1
• Molecular Formula: C17H14Cl2N4O2

Synonyms:N-((3,4-Dichlorophenyl)carbamoyl)-3-phenethylsydnone imine;Sydnone imine, N-((3,4-dichlorophenyl)carbamoyl)-3-phenethyl-;(5E)-5-{[(3,4-dichlorophenyl)carbamoyl]imino}-3-(2-phenylethyl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide;67629-52-1;C17H15Cl2N4O2;SCHEMBL1348458;SCHEMBL12130936;C17-H15-Cl2-N4-O2;STK764999;AKOS001660523;LS-148358;SR-01000463683;SR-01000463683-1;(E)-5-(((3,4-dichlorophenyl)carbamoyl)imino)-3-phenethyl-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide

Chemical Property of (5E)-5-{[(3,4-dichlorophenyl)carbamoyl]imino}-3-(2-phenylethyl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide

Chemical Property:

• XLogP3: 5.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 376.0493811
• Heavy Atom Count: 25
• Complexity: 448

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC[N+]2=NOC(=C2)N=C(NC3=CC(=C(C=C3)Cl)Cl)[O-]
• Isomeric SMILES: C1=CC=C(C=C1)CC[N+]2=NOC(=C2)/N=C(/NC3=CC(=C(C=C3)Cl)Cl)\[O-]

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