N-{2-[1-(6-Carbamoylthieno[3,2-D]Pyrimidin-4-Yl)-4-Piperidinyl]Ethyl}-N'-Ethyl-2,5-Thiophenedicarboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C22H26N6O3S2
IUPAC Name n2-[2-[1-(6-carbamoylthieno[3,2-d]pyrimidin-4-yl)-4-piperidyl]ethyl]-n5-ethyl-thiophene-2,5-dicarboxamide
Molecular Mass 486.610 g·mol−1
Heat of Formation -228.9 ± 16.7 kJ·mol−1
Dipole Moment 7.24 ± 1.08 D
Volume 558.61 Å 3
Surface Area 492.72 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.61 ± eV
Point Group Symmetry C1
InChIKey IXDTWYVAYLILOL-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N