(2R)-1-[2-({[(2R,3R,6R)-6-Amino-2-Methyl-3-Piperidinyl]Methyl}Amino)Ethyl]-6-Chloro-3-{[2,2-Difluoro-2-(2-Pyridinyl)Ethyl]Amino}-1,2-Dihydro-2-Pyrazinol
Properties
| Property | Value |
|---|---|
| Formula | C20H30ClF2N7O |
| IUPAC Name | (2r)-1-[2-[[(2r,3r,6r)-6-amino-2-methyl-3-piperidyl]methylamino]ethyl]-6-chloro-3-[[2,2-difluoro-2-(2-pyridyl)ethyl]amino]-2h-pyrazin-2-ol |
| Molecular Mass | 457.948 g·mol−1 |
| Heat of Formation | -402.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.42 ± 1.08 D |
| Volume | 535.83 Å 3 |
| Surface Area | 459.53 Å 2 |
| HOMO Energy | -8.24 ± 0.55 eV |
| LUMO Energy | 2.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MQHPMJMCBRFLML-BCXHYRKLSA-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 |