3-Hydroxymethyl Maraviroc

For research use only. Not for therapeutic Use.

  • CAT Number: R008825
  • CAS Number: 1217535-55-1
  • Molecular Formula: C29H41F2N5O2
  • Molecular Weight: 529.677
  • Purity: ≥95%
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Catalog Number R008825
CAS Number 1217535-55-1
Synonyms

4,4-Difluoro-N-[(1S)-1-(4-phenyl)-3-[(3-exo)-3-[3-hydroxymethyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]oct-8-yl]propyl]-cyclohexanecarboxamide

Molecular Formula C29H41F2N5O2
Purity ≥95%
Storage -20°C
IUPAC Name 4,4-difluoro-N-[(1S)-3-[3-[3-(hydroxymethyl)-5-propan-2-yl-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]cyclohexane-1-carboxamide
InChI InChI=1S/C29H41F2N5O2/c1-19(2)27-34-33-26(18-37)36(27)24-16-22-8-9-23(17-24)35(22)15-12-25(20-6-4-3-5-7-20)32-28(38)21-10-13-29(30,31)14-11-21/h3-7,19,21-25,37H,8-18H2,1-2H3,(H,32,38)/t22?,23?,24?,25-/m0/s1
InChIKey QYAXWUVUSZZECX-DGGBHQDZSA-N
SMILES CC(C)C1=NN=C(N1C2CC3CCC(C2)N3CCC(C4=CC=CC=C4)NC(=O)C5CCC(CC5)(F)F)CO

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