3-(4-Oxo-1,4-Dihydro-2-Quinazolinyl)-N-[1-(4-Pyridinyl)Ethyl]Propanamide
Properties
Property | Value |
---|---|
Formula | C18H18N4O2 |
IUPAC Name | 3-(4-oxoquinazolin-3-ium-2-yl)-n-[(1s)-1-(4-pyridyl)ethyl]propanamide |
Molecular Mass | 322.361 g·mol−1 |
Heat of Formation | -127.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.80 ± 1.08 D |
Volume | 384.15 Å 3 |
Surface Area | 354.38 Å 2 |
HOMO Energy | -9.31 ± 0.55 eV |
LUMO Energy | -1.12 ± eV |
Point Group Symmetry | C1 |
InChIKey | WHSYWXUBGUCCCU-LBPRGKRZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |