2-{5-[(4-Methyl-1-Piperazinyl)Sulfonyl]-2-Propoxyphenyl}-1,5,6,7-Tetrahydro-4H-Cyclopenta[D]Pyrimidin-4-One
Properties
Property | Value |
---|---|
Formula | C21H28N4O4S |
IUPAC Name | 2-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one |
Molecular Mass | 432.536 g·mol−1 |
Heat of Formation | -494.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.80 ± 1.08 D |
Volume | 510.68 Å 3 |
Surface Area | 428.96 Å 2 |
HOMO Energy | -8.93 ± 0.55 eV |
LUMO Energy | -1.13 ± eV |
Point Group Symmetry | C1 |
InChIKey | GVJMOYXLONOQAI-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |