| Formula |
C22H31F3N6O2 |
| IUPAC Name |
1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methyl-pyrimidine-2,4-dione |
| Molecular Mass |
468.516 g·mol−1 |
| Heat of Formation |
-942.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.01 ± 1.08 D |
| Volume |
554.32 Å 3 |
| Surface Area |
478.0 Å 2 |
| HOMO Energy |
-9.24 ± 0.55 eV |
| LUMO Energy |
-0.82 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl]butyl]-5-methylpyrimidine-2,4-dione
- 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methyl-pyrimidine-2,4-quinone
- 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methylpyrimidine-2,4-dione
|
| InChIKey |
LRAYIUHUAWSEDX-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
N
O
F
|
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