| Formula |
C27H28F3N5O2S |
| IUPAC Name |
λ1-azanyl-[5-[6-[(4-methylpiperazin-1-yl)methyl]benzimidazol-3-ium-6-id-1-yl]-3-[(1r)-1-[2-(trifluoromethyl)benzene-3,4,5,6-tetraid-1-yl]ethoxy]-2-thienyl]methanone |
| Molecular Mass |
543.604 g·mol−1 |
| Heat of Formation |
-547.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.25 ± 1.08 D |
| Volume |
612.08 Å 3 |
| Surface Area |
503.62 Å 2 |
| HOMO Energy |
-8.81 ± 0.55 eV |
| LUMO Energy |
1.70 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-[6-[(4-methyl-1-piperazinyl)methyl]-1-benzimidazolyl]-3-[(1r)-1-[2-(trifluoromethyl)phenyl]ethoxy]-2-thiophenecarboxamide
- 5-[6-[(4-methylpiperazin-1-yl)methyl]benzimidazol-1-yl]-3-[(1r)-1-[2-(trifluoromethyl)phenyl]ethoxy]thiophene-2-carboxamide
|
| InChIKey |
ZHJGWYRLJUCMRT-QGZVFWFLSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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