Formula |
C25H25NO4S |
IUPAC Name |
(2s)-3-[2-[(5-methyl-2-phenyl-oxazol-4-yl)methyl]benzofuran-5-yl]-2-propylsulfanyl-propanoic acid |
Molecular Mass |
435.535 g·mol−1 |
Heat of Formation |
-391.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.28 ± 1.08 D |
Volume |
514.89 Å 3 |
Surface Area |
454.49 Å 2 |
HOMO Energy |
-8.88 ± 0.55 eV |
LUMO Energy |
-0.60 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-3-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1-benzofuran-5-yl]-2-propylsulfanyl-propanoic acid
- (2s)-3-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1-benzofuran-5-yl]-2-propylsulfanylpropanoic acid
- (2s)-3-[2-[(5-methyl-2-phenyl-4-oxazolyl)methyl]-5-benzofuranyl]-2-(propylthio)propanoic acid
- (2s)-3-[2-[(5-methyl-2-phenyl-oxazol-4-yl)methyl]benzofuran-5-yl]-2-(propylthio)propionic acid
- (2s)-3-[2-[(5-methyl-2-phenyl-oxazol-4-yl)methyl]benzofuran-5-yl]-2-propylsulfanyl-propanoic acid
|
InChIKey |
JWYZUNXLVDVFIH-QHCPKHFHSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
S
C
O
N
|
|
|