Formula |
C27H22F2N8O2 |
IUPAC Name |
1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluoro-phenyl]-7-fluoro-indazole-3-carboxamide |
Molecular Mass |
528.513 g·mol−1 |
Heat of Formation |
168.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.75 ± 1.08 D |
Volume |
594.94 Å 3 |
Surface Area |
489.22 Å 2 |
HOMO Energy |
-9.01 ± 0.55 eV |
LUMO Energy |
-1.21 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(dimethylaminomethyl)-1-imidazolyl]-2-fluorophenyl]-7-fluoro-3-indazolecarboxamide
- 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluoro-phenyl]-7-fluoro-indazole-3-carboxamide
- 1-(3-amino-1,2-benzoxazol-5-yl)-6-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluorophenyl]-7-fluoroindazole-3-carboxamide
- 1-(3-aminoindoxazen-5-yl)-6-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluoro-phenyl]-7-fluoro-indazole-3-carboxamide
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InChIKey |
MGUDDBRJHXFTEY-UHFFFAOYSA-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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