Formula |
C19H26N6O2 |
IUPAC Name |
2-[[[2-[[(1r)-1-(hydroxymethyl)propyl]amino]-9-isopropyl-purin-6-yl]amino]methyl]phenol |
Molecular Mass |
370.449 g·mol−1 |
Heat of Formation |
-150.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.87 ± 1.08 D |
Volume |
458.77 Å 3 |
Surface Area |
400.18 Å 2 |
HOMO Energy |
-8.40 ± 0.55 eV |
LUMO Energy |
2.89 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[[[2-[[(1r)-1-(hydroxymethyl)propyl]amino]-9-isopropyl-6-purinyl]amino]methyl]phenol
- 2-[[[2-[[(1r)-1-(hydroxymethyl)propyl]amino]-9-isopropyl-purin-6-yl]amino]methyl]phenol
- 2-[[[2-[[(2r)-1-hydroxybutan-2-yl]amino]-9-propan-2-yl-purin-6-yl]amino]methyl]phenol
- 2-[[[2-[[(2r)-1-hydroxybutan-2-yl]amino]-9-propan-2-ylpurin-6-yl]amino]methyl]phenol
- 2-[[[9-isopropyl-2-[[(1r)-1-methylolpropyl]amino]purin-6-yl]amino]methyl]phenol
- 6-(2-hydroxybenzylamino)-2-((1r)-(hydroxymethyl)propyl)amino)-9-isopropylpurine
- ck9
- olomoucine ii
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InChIKey |
NDUVSANREQEDRE-CQSZACIVSA-N |
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Elements |
H
C
O
N
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