1,3-Bis[4-(4-Ethyl-2,3-Dioxo-1-Piperazinyl)Butyl]Urea

Molecule SVG Image

Properties Simple | Detailed

Formula C21H36N6O5
IUPAC Name 1,3-bis[4-(4-ethyl-2,3-dioxo-piperazin-1-yl)butyl]urea
Molecular Mass 452.548 g·mol−1
Heat of Formation -962.6 ± 16.7 kJ·mol−1
Dipole Moment 16.28 ± 1.08 D
Volume 560.61 Å 3
Surface Area 422.24 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-bedp-bu
  • 1,3-bis(4-(4-ethyl-2,3-dioxo-1-piperazinyl)butyl)urea
  • 1,3-bis[4-(4-ethyl-2,3-diketo-piperazin-1-yl)butyl]urea
  • 1,3-bis[4-(4-ethyl-2,3-dioxopiperazin-1-yl)butyl]urea
  • urea, n,n'-bis(4-(4-ethyl-2,3-dioxo-1-piperazinyl)butyl)-
CAS Number(s)
  • 77439-72-6
InChIKey TULFHXPGSKNDDQ-UHFFFAOYSA-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