(2R)-2-Benzyl-3-[4-Propoxy-3-({[4-(2-Pyrimidinyl)Benzoyl]Amino}Methyl)Phenyl]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C31H31N3O4 |
IUPAC Name | (2r)-2-benzyl-3-[4-propoxy-3-[[(4-pyrimidin-2-ylbenzoyl)amino]methyl]phenyl]propanoic acid |
Molecular Mass | 509.596 g·mol−1 |
Heat of Formation | -374.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.53 ± 1.08 D |
Volume | 628.98 Å 3 |
Surface Area | 535.04 Å 2 |
HOMO Energy | -9.07 ± 0.55 eV |
LUMO Energy | 1.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | DEAVJKJURZRSJV-AREMUKBSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |