6-(1,3-Benzodioxol-5-Yl)-N-(2-Thienylmethyl)-4-Quinazolinamine

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Properties Simple | Detailed

Formula C20H15N3O2S
IUPAC Name 6-(1,3-benzodioxol-5-yl)-n-(2-thienylmethyl)quinazolin-4-amine
Molecular Mass 361.417 g·mol−1
Heat of Formation 190.8 ± 16.7 kJ·mol−1
Dipole Moment 5.10 ± 1.08 D
Volume 403.61 Å 3
Surface Area 368.61 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • 6-(1,3-benzodioxol-5-yl)-n-(2-thienylmethyl)quinazolin-4-amine
  • 6-(1,3-benzodioxol-5-yl)-n-(thiophen-2-ylmethyl)quinazolin-4-amine
  • [6-(1,3-benzodioxol-5-yl)quinazolin-4-yl]-(2-thienylmethyl)amine
  • pcop-13800
InChIKey QFBOPHGXTBOQRN-UHFFFAOYSA-N
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