N-{2-[(4-{[3-(Tert-Butylamino)Pyridin-2-Yl](Methyl)Amino}Piperidin-1-Yl)Carbonyl]-1H-Indol-5-Yl}Methanesulfonamide

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Properties Simple | Detailed

Formula C25H34N6O3S
IUPAC Name n-[2-[4-[[3-(tert-butylamino)-2-pyridyl]-methyl-amino]piperidine-1-carbonyl]-1h-indol-5-yl]methanesulfonamide
Molecular Mass 498.641 g·mol−1
Heat of Formation -302.1 ± 16.7 kJ·mol−1
Dipole Moment 5.86 ± 1.08 D
Volume 592.56 Å 3
Surface Area 496.43 Å 2
HOMO Energy -8.27 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1-((5-methanesulfonamidoindol-2-yl)carbonyl)-4-(n-methyl-n-(3-((1,1-dimethylethyl)amino)-2-pyridinyl)amino)piperidine
  • 1-[(5-methanesulfonamidoindol-2-yl)carbonyl]-4-[n-methyl-n-[3-[(1,1-dimethylethyl)amino]-2-pyridinyl]amino]piperidine
  • 4-piperidinamine, n-(3-((1,1-dimethylethyl)amino)-2-pyridinyl)-n-methyl-1-((5-((methylsulfonyl)amino)-1h-indol-2-yl)carbonyl)-
  • 4-piperidinamine, n-[3-[(1,1-dimethylethyl)amino]-2-pyridinyl]-n-methyl-1-[[5-[(methylsulfonyl)amino]-1h-indol-2-yl]carbonyl]-
  • n-[2-[4-[[3-(tert-butylamino)-2-pyridyl]-methyl-amino]piperidine-1-carbonyl]-1h-indol-5-yl]methanesulfonamide
  • n-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-methyl-amino]piperidin-1-yl]carbonyl-1h-indol-5-yl]methanesulfonamide
  • n-[2-[4-[[3-(tert-butylamino)pyridin-2-yl]-methylamino]piperidine-1-carbonyl]-1h-indol-5-yl]methanesulfonamide
  • n-[2-[[4-[[3-(tert-butylamino)-2-pyridyl]-methylamino]-1-piperidinyl]-oxomethyl]-1h-indol-5-yl]methanesulfonamide
  • u-95133
CAS Number(s)
  • 177577-59-2
InChIKey LBKLPWXCROFAEP-UHFFFAOYSA-N
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