N-[(2S,3R)-1-(3,5-Difluorophenyl)-4-({1-[4-(2,2-Dimethylpropyl)-2-Thienyl]Cyclopropyl}Amino)-3-Hydroxy-2-Butanyl]Acetamide
Properties
Property | Value |
---|---|
Formula | C24H32F2N2O2S |
IUPAC Name | n-[(1s,2r)-1-[(3,5-difluorophenyl)methyl]-3-[[1-[4-(2,2-dimethylpropyl)-2-thienyl]cyclopropyl]amino]-2-hydroxy-propyl]acetamide |
Molecular Mass | 450.585 g·mol−1 |
Heat of Formation | -662.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.62 ± 1.08 D |
Volume | 570.63 Å 3 |
Surface Area | 453.25 Å 2 |
HOMO Energy | -8.68 ± 0.55 eV |
LUMO Energy | 2.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | YEGCCSKZPHGALE-LEWJYISDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H O N S |