2-(4-Methyl-1-Piperazinyl)-5-(2,3,5-Trichlorophenyl)-4-Pyrimidinamine

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Properties Simple | Detailed

Formula C15H16Cl3N5
IUPAC Name 2-(4-methylpiperazin-1-yl)-5-(2,3,5-trichlorophenyl)pyrimidin-4-amine
Molecular Mass 372.680 g·mol−1
Heat of Formation 152.4 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 400.33 Å 3
Surface Area 351.94 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-2-(4-methyl-1-piperazinyl)-5-(2,3,5-trichlorophenyl)pyrimidine
  • 4-pyrimidinamine, 2-(4-methyl-1-piperazinyl)-5-(2,3,5-trichlorophenyl)-
  • 619c89
  • [2-(4-methylpiperazin-1-yl)-5-(2,3,5-trichlorophenyl)pyrimidin-4-yl]amine
  • bw 619c89
  • bw-619c89
  • bw619c89
  • sipatrigine
CAS Number(s)
  • 130800-90-7
InChIKey PDOCBJADCWMDGL-UHFFFAOYSA-N
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Elements H C N Cl