Formula |
C31H39N5O4 |
IUPAC Name |
(4s)-n-[(1s,2r)-1-benzyl-3-[[3-(dimethylamino)phenyl]methylamino]-2-hydroxy-propyl]-1-[(3-methoxyphenyl)methyl]-2-oxo-imidazolidine-4-carboxamide |
Molecular Mass |
545.672 g·mol−1 |
Heat of Formation |
-426.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.57 ± 1.08 D |
Volume |
679.55 Å 3 |
Surface Area |
523.7 Å 2 |
HOMO Energy |
-8.27 ± 0.55 eV |
LUMO Energy |
3.17 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MCBWJRZWLSXSBN-YTCPBCGMSA-N |
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Elements |
H
C
O
N
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