2-[2-(5-Chloro-1H-Indol-3-Yl)Ethyl]-3-(3-Isopropoxyphenyl)-4(3H)-Quinazolinone

Molecule SVG Image

Properties Simple | Detailed

Formula C27H24ClN3O2
IUPAC Name 2-[2-(5-chloro-1h-indol-3-yl)ethyl]-3-(3-isopropoxyphenyl)quinazolin-4-one
Molecular Mass 457.951 g·mol−1
Heat of Formation -58.0 ± 16.7 kJ·mol−1
Dipole Moment 5.12 ± 1.08 D
Volume 529.38 Å 3
Surface Area 390.42 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 2.50 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-(5-chloro-1h-indol-3-yl)ethyl]-3-(3-isopropoxyphenyl)-4-quinazolinone
  • 2-[2-(5-chloro-1h-indol-3-yl)ethyl]-3-(3-isopropoxyphenyl)quinazolin-4-one
  • 2-[2-(5-chloro-1h-indol-3-yl)ethyl]-3-(3-propan-2-yloxyphenyl)quinazolin-4-one
  • 2-[2-(5-chloro-1h-indol-3-yl)ethyl]-3-[3-(1-methylethoxy)phenyl]-4(3h)-quinazolinone
  • 4(3h)-quinazolinone, 2-(2-(5-chloro-1h-indol-3-yl)ethyl)-3-(3-(1-methylethoxy)phenyl)-
  • ly 202,769
  • ly 202769
  • ly-202769
CAS Number(s)
  • 139543-40-1
InChIKey DWDPCGQQNLAFEN-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl