Formula |
C31H27F3N4O3S2 |
IUPAC Name |
n-[4-[2-[[(2r)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]thiazol-2-yl]benzenesulfonamide |
Molecular Mass |
624.696 g·mol−1 |
Heat of Formation |
-629.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.68 ± 1.08 D |
Volume |
700.44 Å 3 |
Surface Area |
514.31 Å 2 |
HOMO Energy |
-8.95 ± 0.55 eV |
LUMO Energy |
-1.40 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- n-[4-[2-[[(2r)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]-2-thiazolyl]benzenesulfonamide
- n-[4-[2-[[(2r)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]thiazol-2-yl]benzenesulfonamide
- n-[4-[2-[[(2r)-2-hydroxy-2-pyridin-3-yl-ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]benzenesulfonamide
- n-[4-[2-[[(2r)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]benzenesulfonamide
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InChIKey |
MSOUIIHPMJCUNI-LJAQVGFWSA-N |
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Links |
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Elements |
C
F
H
O
N
S
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