Formula |
C31H35F3N4O3 |
IUPAC Name |
n-[(1s,2r)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide |
Molecular Mass |
568.630 g·mol−1 |
Heat of Formation |
-1043.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.69 ± 1.08 D |
Volume |
628.77 Å 3 |
Surface Area |
496.04 Å 2 |
HOMO Energy |
-8.49 ± 0.55 eV |
LUMO Energy |
2.42 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-ethylamino-n-[(1s,2r)-2-hydroxy-1-(phenylmethyl)-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-5-(2-oxo-1-pyrrolidinyl)benzamide
- 3-ethylamino-n-[(1s,2r)-2-hydroxy-1-(phenylmethyl)-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-5-(2-oxopyrrolidin-1-yl)benzamide
- 3-ethylamino-n-[(2s,3r)-3-hydroxy-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-5-(2-oxopyrrolidin-1-yl)benzamide
- n-[(1s,2r)-1-(benzyl)-2-hydroxy-3-[[3-(trifluoromethyl)benzyl]amino]propyl]-3-ethylamino-5-(2-ketopyrrolidin-1-yl)benzamide
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InChIKey |
QPGDTFHILHXFBQ-WUFINQPMSA-N |
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Links |
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Downloads |
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Elements |
H
C
F
O
N
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