Formula |
C18H22F2N4O |
IUPAC Name |
(1s)-1-(4-fluorophenyl)-4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butan-1-ol |
Molecular Mass |
348.390 g·mol−1 |
Heat of Formation |
-314.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.79 ± 1.08 D |
Volume |
412.49 Å 3 |
Surface Area |
372.41 Å 2 |
HOMO Energy |
-8.86 ± 0.55 eV |
LUMO Energy |
2.50 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- (1s)-1-(4-fluorophenyl)-4-[4-(5-fluoro-2-pyrimidinyl)-1-piperazinyl]butan-1-ol
- (1s)-1-(4-fluorophenyl)-4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butan-1-ol
|
InChIKey |
ZXUYYZPJUGQHLQ-KRWDZBQOSA-N |
QR Code |
Generate QR Code |
Links |
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DOI |
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Downloads |
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Elements |
H
C
N
O
F
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