4-(2-((2-(Dimethylamino)Ethyl)-(3-Pyridinylmethyl)Amino)-4-Thiazolyl)-2,6-Bis(1,1-Dimethylethyl)Phenol

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Properties Simple | Detailed

Formula C27H38N4OS
IUPAC Name 2,6-ditert-butyl-4-[2-[2,3-dihydropyridin-2-ylium-3-id-5-ylmethyl-[2-(dimethylamino)ethyl]amino]-5h-thiazol-3-ium-5-id-4-yl]phenol
Molecular Mass 466.682 g·mol−1
Heat of Formation 474.6 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 598.07 Å 3
Surface Area 481.79 Å 2
HOMO Energy -8.26 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-ditert-butyl-4-[2-(2-dimethylaminoethyl-(3-pyridylmethyl)amino)-4-thiazolyl]phenol
  • 2,6-ditert-butyl-4-[2-(2-dimethylaminoethyl-(3-pyridylmethyl)amino)thiazol-4-yl]phenol
  • 2,6-ditert-butyl-4-[2-(2-dimethylaminoethyl-(pyridin-3-ylmethyl)amino)-1,3-thiazol-4-yl]phenol
  • n(2-dimethylaminoethyl)-n-(3-pyridinylmethyl(4-(3,5-di(tert-butyl)-4-hydroxyphenyl)thiazol-2-yl))amine
  • phenol, 4-(2-((2-(dimethylamino)ethyl)-(3-pyridinylmethyl)amino)-4-thiazolyl)-2,6-bis(1,1-dimethylethyl)-
  • sr 27388
  • sr-27388
CAS Number(s)
  • 136468-89-8
InChIKey OIKOWHLZKUWDMH-UHFFFAOYSA-N
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