| Formula |
C22H23BrN4O5S |
| IUPAC Name |
(2s,4r)-4-[[8-bromo-7-methoxy-2-[2-(2-methylpropanoylamino)thiazol-4-yl]-4-quinolyl]oxy]pyrrolidine-2-carboxylic acid |
| Molecular Mass |
535.411 g·mol−1 |
| Heat of Formation |
-548.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.72 ± 1.08 D |
| Volume |
544.27 Å 3 |
| Surface Area |
480.99 Å 2 |
| HOMO Energy |
-8.58 ± 0.55 eV |
| LUMO Energy |
1.98 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
QSUXZKXMOTVMGR-RISCZKNCSA-N |
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| DOI |
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|
| Elements |
C
H
O
N
S
Br
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