| Formula |
C20H28N6O3 |
| IUPAC Name |
2-[2-hydroxyethyl-[9-isopropyl-6-[(4-methoxyphenyl)methylamino]purin-9-ium-2-yl]amino]ethanol |
| Molecular Mass |
400.475 g·mol−1 |
| Heat of Formation |
-252.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.08 ± 1.08 D |
| Volume |
494.59 Å 3 |
| Surface Area |
424.37 Å 2 |
| HOMO Energy |
-8.15 ± 0.55 eV |
| LUMO Energy |
-0.06 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2(bis-(hydroxyethyl)amino)-6-(4-methoxybenzylamino)-9-isopropyl-purine
- 2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol
- 2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]ethanol
- 2-[2-hydroxyethyl-[9-isopropyl-6-[(4-methoxybenzyl)amino]purin-2-yl]amino]ethanol
- 2-[2-hydroxyethyl-[9-isopropyl-6-[(4-methoxyphenyl)methylamino]-2-purinyl]amino]ethanol
- 2-[2-hydroxyethyl-[9-isopropyl-6-[(4-methoxyphenyl)methylamino]purin-2-yl]amino]ethanol
- cdk2 inhibitor iii
- cvt-313
- hsci1_000262
|
| InChIKey |
NQVIIUBWMBHLOZ-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
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