N-{(2S,3R)-4-[(2,6-Dimethyl-2-Heptanyl)Amino]-3-Hydroxy-1-Phenyl-2-Butanyl}-3-(Ethylamino)-5-(2-Oxo-1-Pyrrolidinyl)Benzamide
Properties
Property | Value |
---|---|
Formula | C32H48N4O3 |
IUPAC Name | n-[(1s,2r)-1-benzyl-2-hydroxy-3-(1,1,5-trimethylhexylamino)propyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide |
Molecular Mass | 536.749 g·mol−1 |
Heat of Formation | -653.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.66 ± 1.08 D |
Volume | 720.26 Å 3 |
Surface Area | 524.11 Å 2 |
HOMO Energy | -8.38 ± 0.55 eV |
LUMO Energy | 2.97 ± eV |
Point Group Symmetry | C1 |
InChIKey | BNTVCVCCNARYIP-URLMMPGGSA-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 |