Formula |
C27H33FN4O2 |
IUPAC Name |
1-[(4r)-4-[3-(4-acetylpiperazin-1-yl)propyl]-2-(2-fluoro-5-methyl-phenyl)-4-phenyl-3h-pyrazol-5-yl]ethanone |
Molecular Mass |
464.575 g·mol−1 |
Heat of Formation |
-260.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.70 ± 1.08 D |
Volume |
573.78 Å 3 |
Surface Area |
427.79 Å 2 |
HOMO Energy |
-8.77 ± 0.55 eV |
LUMO Energy |
2.29 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-[(4r)-4-[3-(4-acetyl-1-piperazinyl)propyl]-1-(2-fluoro-5-methylphenyl)-4-phenyl-5h-pyrazol-3-yl]ethanone
- 1-[(4r)-4-[3-(4-acetylpiperazin-1-yl)propyl]-1-(2-fluoro-5-methyl-phenyl)-4-phenyl-5h-pyrazol-3-yl]ethanone
- 1-[(4r)-4-[3-(4-acetylpiperazin-1-yl)propyl]-1-(2-fluoro-5-methylphenyl)-4-phenyl-5h-pyrazol-3-yl]ethanone
- 1-[(4r)-4-[3-(4-ethanoylpiperazin-1-yl)propyl]-1-(2-fluoro-5-methyl-phenyl)-4-phenyl-5h-pyrazol-3-yl]ethanone
- mkk
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InChIKey |
RYUBEOMELHCHMO-MHZLTWQESA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
F
O
N
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