N-[9-Chloro-2-(2-Furyl)[1,2,4]Triazolo[1,5-C]Quinazolin-5-Yl]-2-Phenylacetamide

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Formula C21H14ClN5O2
IUPAC Name n-(9-chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-phenylacetamide
Molecular Mass 403.821 g·mol−1
Heat of Formation 322.6 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 441.34 Å 3
Surface Area 402.08 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
Synonyms
  • 9-chloro-2-(2-furanyl)-5-((phenylacetyl)amino)-[1,2,4]triazolo[1,5-c]quinazoline
  • mrs 1220
  • n-(9-chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-phenyl-ethanamide
  • n-[9-chloro-2-(2-furyl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]-2-phenyl-acetamide
  • n-[9-chloro-2-(2-furyl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]-2-phenylacetamide
  • tocris-1217
InChIKey TWWFAXQOKNBUCR-UHFFFAOYSA-N
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Elements H C N O Cl