Formula |
C27H27ClFN5O4S |
IUPAC Name |
(2s,4r)-4-[(5-chlorothiophene-2-carbonyl)amino]-n-(cyclopropylmethyl)-1-[2-[2-fluoro-4-(2-oxo-1-pyridyl)anilino]-2-oxo-ethyl]pyrrolidine-2-carboxamide |
Molecular Mass |
572.051 g·mol−1 |
Heat of Formation |
-484.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.43 ± 1.08 D |
Volume |
605.79 Å 3 |
Surface Area |
539.08 Å 2 |
HOMO Energy |
-8.68 ± 0.55 eV |
LUMO Energy |
-1.26 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LRFNMAKOTZSBFP-UTKZUKDTSA-N |
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Elements |
C
Cl
H
F
O
N
S
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