(2R,4S)-2-[(1R)-1-({(2R)-2-[(4-Ethyl-2,3-Dioxo-1-Piperazinyl)Amino]-2-Phenylacetyl}Amino)-2-Oxoethyl]-5,5-Dimethyl-1,3-Thiazolidine-4-Carboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C22H29N5O6S
IUPAC Name (2r,4s)-2-[(1r)-1-[[(2r)-2-[(4-ethyl-2,3-dioxo-piperazin-1-yl)amino]-2-phenyl-acetyl]amino]-2-oxo-ethyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid
Molecular Mass 491.561 g·mol−1
Heat of Formation -800.6 ± 16.7 kJ·mol−1
Dipole Moment 5.97 ± 1.08 D
Volume 565.45 Å 3
Surface Area 454.16 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy 2.66 ± eV
Point Group Symmetry C1
InChIKey FLMJTSOTBGMFLJ-XLMAVXFVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N