N-[(2S)-1-{[4-(5-Bromo-2-Pyridinyl)-1-Piperazinyl]Sulfonyl}-5-(2-Pyrimidinyl)-2-Pentanyl]-N-Hydroxyformamide

Molecule SVG Image

Properties Simple | Detailed

Formula C19H25BrN6O4S
IUPAC Name n-[(1s)-1-[[4-(5-bromo-2-pyridyl)piperazin-1-yl]sulfonylmethyl]-4-pyrimidin-2-yl-butyl]-n-hydroxy-formamide
Molecular Mass 513.409 g·mol−1
Heat of Formation -293.8 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 527.26 Å 3
Surface Area 450.08 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s)-1-[[4-(5-bromo-2-pyridyl)-1-piperazinyl]sulfonylmethyl]-4-(2-pyrimidinyl)butyl]-n-hydroxyformamide
  • n-[(1s)-1-[[4-(5-bromo-2-pyridyl)piperazin-1-yl]sulfonylmethyl]-4-pyrimidin-2-yl-butyl]-n-hydroxy-formamide
  • n-[(2s)-1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]sulfonyl-5-pyrimidin-2-yl-pentan-2-yl]-n-hydroxy-methanamide
  • n-[(2s)-1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]sulfonyl-5-pyrimidin-2-ylpentan-2-yl]-n-hydroxyformamide
InChIKey KOKUKBSLFSEGAT-KRWDZBQOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C H O N S Br