Urea, N-[3-(2,4-Dimethyl-5-Thiazolyl)-1,4-Dihydro-4-Oxoindeno[1,2-C]Pyrazol-5-Yl]-N'-(4-Methyl-1-Piperazinyl)-

Molecule SVG Image

Properties Simple | Detailed

Formula C21H23N7O2S
IUPAC Name 1-[3-(2,4-dimethylthiazol-5-yl)-4-oxo-indeno[1,2-c]pyrazol-2-ium-3a-id-5-yl]-3-(4-methylpiperazin-1-yl)urea
Molecular Mass 437.518 g·mol−1
Heat of Formation 216.1 ± 16.7 kJ·mol−1
Dipole Moment 5.46 ± 1.08 D
Volume 501.87 Å 3
Surface Area 420.18 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3-(2,4-dimethylthiazol-5-yl)-4-oxo-2,4-dihydroindeno[1,2-c]pyrazol-5-yl)-3-(4-methylpiperazin-1-yl)urea
  • 3-[3-(2,4-dimethyl-1,3-thiazol-5-yl)-4-oxo-2h-indeno[1,2-c]pyrazol-5-yl]-1-(4-methylpiperazin-1-yl)urea
  • 3-[3-(2,4-dimethyl-5-thiazolyl)-4-oxo-2h-indeno[1,2-c]pyrazol-5-yl]-1-(4-methyl-1-piperazinyl)urea
  • 3-[3-(2,4-dimethylthiazol-5-yl)-4-keto-2h-indeno[1,2-c]pyrazol-5-yl]-1-(4-methylpiperazin-1-yl)urea
  • 3-[3-(2,4-dimethylthiazol-5-yl)-4-oxo-2h-indeno[1,2-c]pyrazol-5-yl]-1-(4-methylpiperazin-1-yl)urea
  • c3 heterocyle indenopyrazole 8q
  • d42
  • dph-042562
InChIKey KRKQVGZXTNLQSV-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N