N-{1-[4-(4-Fluorophenoxy)Butyl]-4-Piperidinyl}-N-Methyl-1,3-Benzothiazol-2-Amine

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Properties Simple | Detailed

Formula C23H28FN3OS
IUPAC Name n-[1-[4-(4-fluorophenoxy)butyl]-4-piperidyl]-n-methyl-1,3-benzothiazol-2-amine
Molecular Mass 413.551 g·mol−1
Heat of Formation -93.4 ± 16.7 kJ·mol−1
Dipole Moment 4.05 ± 1.08 D
Volume 503.34 Å 3
Surface Area 443.19 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-benzothiazol-2-yl-[1-[4-(4-fluorophenoxy)butyl]-4-piperidyl]-methyl-amine
  • 2-benzothiazolamine, n-(1-(4-(4-fluorophenoxy)butyl)-4-piperidinyl)-n-methyl-
  • n-(1-(4-(4-fluorophenoxy)butyl)-4-piperidinyl)-n-methyl-2-benzothiazolamine
  • n-[1-[4-(4-fluorophenoxy)butyl]-4-piperidinyl]-n-methyl-1,3-benzothiazol-2-amine
  • n-[1-[4-(4-fluorophenoxy)butyl]-4-piperidyl]-n-methyl-1,3-benzothiazol-2-amine
  • n-[1-[4-(4-fluorophenoxy)butyl]piperidin-4-yl]-n-methyl-1,3-benzothiazol-2-amine
  • r 56865
CAS Number(s)
  • 104606-13-5
InChIKey PZPXREFPAFDHNG-UHFFFAOYSA-N
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