Formula |
C21H25N7 |
IUPAC Name |
6-(4-methylpiperazin-1-yl)-n-(5-methyl-1h-pyrazol-3-yl)-2-[(e)-styryl]pyrimidin-4-amine |
Molecular Mass |
375.470 g·mol−1 |
Heat of Formation |
504.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.15 ± 1.08 D |
Volume |
462.27 Å 3 |
Surface Area |
413.12 Å 2 |
HOMO Energy |
-8.45 ± 0.55 eV |
LUMO Energy |
1.40 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 6-(4-methylpiperazin-1-yl)-n-(5-methyl-1h-pyrazol-3-yl)-2-[(e)-2-phenylvinyl]pyrimidin-4-amine
- [6-(4-methylpiperazin-1-yl)-2-[(e)-2-phenylvinyl]pyrimidin-4-yl]-(5-methyl-1h-pyrazol-3-yl)amine
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InChIKey |
BLQYVHBZHAISJM-CMDGGOBGSA-N |
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Links |
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Elements |
H
C
N
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