Formula |
C25H25N3O4S |
IUPAC Name |
3-[5-ethoxy-2-[[4-[(2-phenylthiazol-4-yl)methoxy]phenyl]methyl]-3h-pyrazol-3-ylium-1-id-4-yl]propanoic acid |
Molecular Mass |
463.549 g·mol−1 |
Heat of Formation |
-211.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.15 ± 1.08 D |
Volume |
550.24 Å 3 |
Surface Area |
493.59 Å 2 |
HOMO Energy |
-8.71 ± 0.55 eV |
LUMO Energy |
1.98 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 3-[3-ethoxy-1-[4-[(2-phenylthiazol-4-yl)methoxy]benzyl]pyrazol-4-yl]propionic acid
- 3-[3-ethoxy-1-[[4-[(2-phenyl-1,3-thiazol-4-yl)methoxy]phenyl]methyl]pyrazol-4-yl]propanoic acid
- 3-[3-ethoxy-1-[[4-[(2-phenyl-4-thiazolyl)methoxy]phenyl]methyl]-4-pyrazolyl]propanoic acid
- 3-[3-ethoxy-1-[[4-[(2-phenylthiazol-4-yl)methoxy]phenyl]methyl]pyrazol-4-yl]propanoic acid
|
InChIKey |
SRFCAWATPLCLMG-UHFFFAOYSA-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
|
|
|