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

Molecule SVG Image

Properties Simple | Detailed

Formula C33H32N8O3
IUPAC Name 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
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
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N