5-Amino-N-[(2S)-2-{[(2,6-Dichlorobenzoyl)(Ethyl)Amino]Methyl}-3,3,3-Trifluoro-2-Hydroxypropyl]-1-(4-Fluorophenyl)-1H-Pyrazole-4-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C23H21Cl2F4N5O3 |
| IUPAC Name | 5-amino-n-[(2s)-2-[[(2,6-dichlorobenzoyl)-ethyl-amino]methyl]-3,3,3-trifluoro-2-hydroxy-propyl]-1-(4-fluorophenyl)pyrazole-4-carboxamide |
| Molecular Mass | 562.344 g·mol−1 |
| Heat of Formation | -1149.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.32 ± 1.08 D |
| Volume | 579.93 Å 3 |
| Surface Area | 470.36 Å 2 |
| HOMO Energy | -8.94 ± 0.55 eV |
| LUMO Energy | -1.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LKQMULLPLYLIGW-QFIPXVFZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H F O N |