1-[7-(2-Chlorophenyl)-8-(4-Chlorophenyl)-2-Methylpyrazolo[1,5-A][1,3,5]Triazin-4-Yl]-3-(Methylamino)-3-Azetidinecarboxamide

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Properties Simple | Detailed

Formula C23H21Cl2N7O
IUPAC Name 1-[7-(2-chlorophenyl)-8-(4-chlorophenyl)-2-methylpyrazolo[5,1-f][1,3,5]triazin-4-yl]-3-methylaminoazetidine-3-carboxamide
Molecular Mass 482.365 g·mol−1
Heat of Formation 371.6 ± 16.7 kJ·mol−1
Dipole Moment 8.47 ± 1.08 D
Volume 532.85 Å 3
Surface Area 448.49 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[7-(2-chlorophenyl)-8-(4-chlorophenyl)-2-methyl-4-pyrazolo[5,1-f][1,3,5]triazinyl]-3-methylamino-3-azetidinecarboxamide
  • 1-[7-(2-chlorophenyl)-8-(4-chlorophenyl)-2-methyl-pyrazolo[5,1-f][1,3,5]triazin-4-yl]-3-methylamino-azetidine-3-carboxamide
InChIKey QYIBQMXFMBCSBZ-UHFFFAOYSA-N
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Elements H C N O Cl