N-{(2S,3R)-3-Hydroxy-4-[(3-Methoxybenzyl)Amino]-1-Phenyl-2-Butanyl}-5-[Methyl(Methylsulfonyl)Amino]-N'-[(1R)-1-Phenylethyl]Isophthalamide

Molecule SVG Image

Properties Simple | Detailed

Formula C36H42N4O6S
IUPAC Name n1-[(1s,2r)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-5-[methyl(methylsulfonyl)amino]-n3-[(1r)-1-phenylethyl]benzene-1,3-dicarboxamide
Molecular Mass 658.807 g·mol−1
Heat of Formation -820.6 ± 16.7 kJ·mol−1
Dipole Moment 5.71 ± 1.08 D
Volume 830.57 Å 3
Surface Area 555.55 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 2.48 ± eV
Point Group Symmetry C1
InChIKey HIQWWDCRULXYDF-SWROZOJRSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N