(3S)-3-({[1-(2-Fluorophenyl)-5-Oxo-2,5-Dihydro-1H-Pyrazol-3-Yl]Carbonyl}Amino)-3-(2-Methylphenyl)Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C20H18FN3O4 |
IUPAC Name | (3s)-3-[[2-(2-fluorophenyl)-3-oxo-1h-pyrazole-5-carbonyl]amino]-3-(o-tolyl)propanoic acid |
Molecular Mass | 383.373 g·mol−1 |
Heat of Formation | -537.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.44 ± 1.08 D |
Volume | 436.73 Å 3 |
Surface Area | 383.89 Å 2 |
HOMO Energy | -9.16 ± 0.55 eV |
LUMO Energy | 1.93 ± eV |
Point Group Symmetry | C1 |
InChIKey | DGGLFHJMXJUSDG-HNNXBMFYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C F O N |