| Formula |
C20H27N7O |
| IUPAC Name |
2-isopropyl-7-(4-methylpiperazin-1-yl)-4-[(5-methyl-4h-pyrazol-1-ium-4-id-3-yl)amino]phthalazin-1-one |
| Molecular Mass |
381.475 g·mol−1 |
| Heat of Formation |
246.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.74 ± 1.08 D |
| Volume |
462.9 Å 3 |
| Surface Area |
403.39 Å 2 |
| HOMO Energy |
-7.96 ± 0.55 eV |
| LUMO Energy |
-0.48 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-isopropyl-7-(4-methyl-1-piperazinyl)-4-[(5-methyl-1h-pyrazol-3-yl)amino]-1-phthalazinone
- 2-isopropyl-7-(4-methylpiperazin-1-yl)-4-[(5-methyl-1h-pyrazol-3-yl)amino]phthalazin-1-one
- 7-(4-methylpiperazin-1-yl)-4-[(5-methyl-1h-pyrazol-3-yl)amino]-2-propan-2-yl-phthalazin-1-one
|
| InChIKey |
VLOGKAVNBJBYON-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
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