(5S)-N-{(2S,3R)-4-[(1,3-Benzothiazol-6-Ylsulfonyl)(Isobutyl)Amino]-3-Hydroxy-1-Phenyl-2-Butanyl}-2-Oxo-3-[2-(Trifluoromethyl)Phenyl]-1,3-Oxazolidine-5-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C32H33F3N4O6S2
IUPAC Name (5s)-n-[(1s,2r)-3-[1,3-benzothiazol-6-ylsulfonyl(isobutyl)amino]-1-benzyl-2-hydroxy-propyl]-2-oxo-3-[2-(trifluoromethyl)phenyl]oxazolidine-5-carboxamide
Molecular Mass 690.753 g·mol−1
Heat of Formation -1414.6 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 751.93 Å 3
Surface Area 487.48 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry C1
InChIKey NMADTNHSJGJGDP-ITHJLQSDSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S