Nalpha-{4-[4-(4-Chlorophenyl)-1-Piperazinyl]-2-Fluorobenzoyl}-N-4-Pyridinyl-D-Tryptophanamide

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Properties Simple | Detailed

Formula C33H30ClFN6O2
IUPAC Name 4-[4-(4-chlorophenyl)piperazin-1-yl]-2-fluoro-n-[(1r)-1-(1h-indol-3-ylmethyl)-2-oxo-2-(4-pyridylamino)ethyl]benzamide
Molecular Mass 597.082 g·mol−1
Heat of Formation -57.5 ± 16.7 kJ·mol−1
Dipole Moment 9.87 ± 1.08 D
Volume 688.63 Å 3
Surface Area 556.55 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey JVZAEFLHUYIXPY-WJOKGBTCSA-N
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Elements C Cl H F O N