Formula |
C24H23NO5S |
IUPAC Name |
(2s)-2-methoxy-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzothiophen-7-yl]propanoic acid |
Molecular Mass |
437.508 g·mol−1 |
Heat of Formation |
-519.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.42 ± 1.08 D |
Volume |
511.2 Å 3 |
Surface Area |
450.48 Å 2 |
HOMO Energy |
-8.20 ± 0.55 eV |
LUMO Energy |
-1.02 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-methoxy-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]-1-benzothiophen-7-yl]propanoic acid
- (2s)-2-methoxy-3-[4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]-7-benzothiophenyl]propanoic acid
- (2s)-2-methoxy-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzothiophen-7-yl]propanoic acid
- (2s)-2-methoxy-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzothiophen-7-yl]propionic acid
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InChIKey |
DAYKLWSKQJBGCS-NRFANRHFSA-N |
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Elements |
H
C
S
O
N
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