N-[(1R,2S)-2-{[(5-Chloro-1H-Indol-2-Yl)Carbonyl]Amino}Cyclohexyl]-5-Methyl-4,5,6,7-Tetrahydro[1,3]Thiazolo[5,4-C]Pyridine-2-Carboxamide

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Properties Simple | Detailed

Formula C23H26ClN5O2S
IUPAC Name (5r)-n-[(1r,2s)-2-[(5-chloro-4h-indol-1-ium-4-ide-2-carbonyl)amino]cyclohexyl]-5-methyl-6,7-dihydro-4h-thiazolo[5,4-c]pyridine-2-carboxamide
Molecular Mass 472.003 g·mol−1
Heat of Formation -140.2 ± 16.7 kJ·mol−1
Dipole Moment 1.67 ± 1.08 D
Volume 547.14 Å 3
Surface Area 444.0 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey ARPFWVKYXJZULB-DLBZAZTESA-N
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