2-({4-[(3R,5S)-3,5-Dimethyl-1-Piperidinyl]-3-Phenoxybenzoyl}Amino)Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C27H28N2O4 |
IUPAC Name | 2-[[4-[(3r,5s)-3,5-dimethyl-1-piperidyl]-3-phenoxy-benzoyl]amino]benzoic acid |
Molecular Mass | 444.522 g·mol−1 |
Heat of Formation | -483.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.00 ± 1.08 D |
Volume | 532.81 Å 3 |
Surface Area | 442.56 Å 2 |
HOMO Energy | -8.47 ± 0.55 eV |
LUMO Energy | 2.29 ± eV |
Point Group Symmetry | C1 |
InChIKey | YMZMFFRGSWCLPY-KDURUIRLSA-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 |