Netazepide

Molecule SVG Image

Properties Simple | Detailed

Formula C28H30N6O3
IUPAC Name 1-[(3r)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3h-1,4-benzodiazepin-3-yl]-3-(3-methylaminophenyl)urea
Molecular Mass 498.576 g·mol−1
Heat of Formation -109.5 ± 16.7 kJ·mol−1
Dipole Moment 4.28 ± 1.08 D
Volume 590.75 Å 3
Surface Area 503.69 Å 2
HOMO Energy -8.05 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(3r)-1-(3,3-dimethyl-2-oxo-butyl)-2-oxo-5-(2-pyridyl)-3h-1,4-benzodiazepin-3-yl]-3-(3-methylaminophenyl)urea
  • 1-[(3r)-1-(3,3-dimethyl-2-oxo-butyl)-2-oxo-5-pyridin-2-yl-3h-1,4-benzodiazepin-3-yl]-3-(3-methylaminophenyl)urea
  • 1-[(3r)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-(2-pyridyl)-3h-1,4-benzodiazepin-3-yl]-3-(3-methylaminophenyl)urea
  • 1-[(3r)-2-keto-1-(2-keto-3,3-dimethyl-butyl)-5-(2-pyridyl)-3h-1,4-benzodiazepin-3-yl]-3-(3-methylaminophenyl)urea
  • pdsp1_000895
  • pdsp2_000881
InChIKey YDZYKNJZCVIKPP-VWLOTQADSA-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