N-Isopropyl-3-[(1S)-1-(1H-Pyrrolo[2,3-B]Pyridin-3-Yl)Ethyl][1,2,4]Triazolo[4,3-B]Pyridazin-6-Amine
Properties
Property | Value |
---|---|
Formula | C17H19N7 |
IUPAC Name | n-propan-2-yl-3-[(1s)-1-(1h-pyrrolo[2,3-b]pyridin-3-yl)ethyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine |
Molecular Mass | 321.380 g·mol−1 |
Heat of Formation | 534.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.80 ± 1.08 D |
Volume | 392.19 Å 3 |
Surface Area | 342.22 Å 2 |
HOMO Energy | -8.72 ± 0.55 eV |
LUMO Energy | 1.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | PUIUZHJXBDSQEZ-NSHDSACASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |