Methyl {(2S)-1-[2-(4-Bromobenzyl)-2-{3-[(3R,6S,10Z)-3-Hydroxy-6-Isopropyl-4,7-Dioxo-5,8-Diazabicyclo[11.2.2]Heptadeca-1(15),10,13,16-Tetraen-3-Yl]Propyl}Hydrazino]-3,3-Dimethyl-1-Oxo-2-Butanyl}Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C36H50BrN5O6
IUPAC Name methyl n-[(1s)-1-[[(4-bromophenyl)methyl-[3-[(3r,6s,10e)-3-hydroxy-6-isopropyl-4,7-dioxo-5,8-diazabicyclo[11.2.2]heptadeca-1(16),10,13(17),14-tetraen-3-yl]propyl]amino]carbamoyl]-2,2-dimethyl-propyl]carbamate
Molecular Mass 728.716 g·mol−1
Heat of Formation -1017.1 ± 16.7 kJ·mol−1
Dipole Moment 4.54 ± 1.08 D
Volume 862.86 Å 3
Surface Area 610.52 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
InChIKey BWYPGXCADMHJEF-MFVTUPNBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C Br O N