Formula |
C19H22N6O2 |
IUPAC Name |
4-[[6-(cyclohexylmethoxy)purin-9-ium-7-id-2-yl]amino]benzamide |
Molecular Mass |
366.417 g·mol−1 |
Heat of Formation |
-46.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.46 ± 1.08 D |
Volume |
431.39 Å 3 |
Surface Area |
383.72 Å 2 |
HOMO Energy |
-8.77 ± 0.55 eV |
LUMO Energy |
-0.83 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 4-(6-cyclohexylmethoxy-9h-purin-2-ylamino)--benzamide
- n41
- o6-cyclohexylmethylguanine deriv. 34
|
InChIKey |
RUUOIINPNMNPIU-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
N
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