N-Isopropyl-N-Phenyladenosine

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Properties Simple | Detailed

Formula C19H23N5O4
IUPAC Name (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(n-isopropylanilino)purin-9-yl]tetrahydrofuran-3,4-diol
Molecular Mass 385.417 g·mol−1
Heat of Formation -387.8 ± 16.7 kJ·mol−1
Dipole Moment 3.88 ± 1.08 D
Volume 445.85 Å 3
Surface Area 372.73 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-(isopropyl-phenyl-amino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(isopropyl-phenyl-amino)purin-9-yl]tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(isopropyl-phenylamino)-9-purinyl]tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(phenyl-propan-2-yl-amino)purin-9-yl]oxolane-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(phenyl-propan-2-ylamino)purin-9-yl]oxolane-3,4-diol
  • adenosine, n-(1-methylethyl)-n-phenyl-
  • isopropylphenyladenosine
  • n6-(phenylisopropyl)-adenosine
  • phenylisopropyladenosine
  • th 162
CAS Number(s)
  • 29193-86-0
InChIKey FOQCCKILBKXEHH-NVQRDWNXSA-N
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