5-Methyl-4-[(2-Methyl-5-{[2-(4-Morpholinyl)Isonicotinoyl]Amino}Phenyl)Amino]-N-(1-Phenylvinyl)Pyrrolo[2,1-F][1,2,4]Triazine-6-Carboxamide
Properties
Property | Value |
---|---|
Formula | C33H32N8O3 |
IUPAC Name | 5-methyl-4-[2-methyl-5-[(2-morpholinopyridine-4-carbonyl)amino]anilino]-n-(1-phenylvinyl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide |
Molecular Mass | 588.659 g·mol−1 |
Heat of Formation | 197.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.41 ± 1.08 D |
Volume | 683.08 Å 3 |
Surface Area | 593.96 Å 2 |
HOMO Energy | -8.72 ± 0.55 eV |
LUMO Energy | -1.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | ABOUJDCZZMNXIR-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |