Formula |
C21H22N8O |
IUPAC Name |
6-methyl-n-(5-methyl-1h-pyrazol-3-yl)-2-[(2s)-2-[3-(2-pyridyl)isoxazol-5-yl]pyrrolidin-1-yl]pyrimidin-4-amine |
Molecular Mass |
402.452 g·mol−1 |
Heat of Formation |
542.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.40 ± 1.08 D |
Volume |
472.84 Å 3 |
Surface Area |
404.54 Å 2 |
HOMO Energy |
-8.26 ± 0.55 eV |
LUMO Energy |
1.36 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (5-methyl-1h-pyrazol-3-yl)-[6-methyl-2-[(2s)-2-[3-(2-pyridyl)isoxazol-5-yl]pyrrolidin-1-yl]pyrimidin-4-yl]amine
- 6-methyl-n-(5-methyl-1h-pyrazol-3-yl)-2-[(2s)-2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine
- 6-methyl-n-(5-methyl-1h-pyrazol-3-yl)-2-[(2s)-2-[3-(2-pyridyl)-5-isoxazolyl]-1-pyrrolidinyl]-4-pyrimidinamine
- 6-methyl-n-(5-methyl-1h-pyrazol-3-yl)-2-[(2s)-2-[3-(2-pyridyl)isoxazol-5-yl]pyrrolidin-1-yl]pyrimidin-4-amine
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InChIKey |
KHGNDLZELXNRQC-KRWDZBQOSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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