| Formula |
C26H33ClF3N5O4S |
| IUPAC Name |
(2s,4r)-4-[2-chloro-4-(4-ethylpiperazin-1-yl)phenyl]sulfonyl-n-(1-methanimidoylcyclopropyl)-1-[1-(trifluoromethyl)cyclopropanecarbonyl]pyrrolidine-2-carboxamide |
| Molecular Mass |
604.085 g·mol−1 |
| Heat of Formation |
-990.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.64 ± 1.08 D |
| Volume |
661.85 Å 3 |
| Surface Area |
525.13 Å 2 |
| HOMO Energy |
-8.99 ± 0.55 eV |
| LUMO Energy |
-0.95 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
XSYZXEOMVXQXMI-DJQPUNJJSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
Cl
O
N
S
|
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