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

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Properties Simple | Detailed

Formula C23H20ClN5O2S
IUPAC Name (5r)-n-[2-[(5-chloroindol-1-ium-2-carbonyl)amino]phenyl]-5-methyl-6,7-dihydro-4h-thiazolo[5,4-c]pyridine-2-carboxamide
Molecular Mass 465.955 g·mol−1
Heat of Formation 125.3 ± 16.7 kJ·mol−1
Dipole Moment 6.88 ± 1.08 D
Volume 519.56 Å 3
Surface Area 457.46 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
InChIKey HLZHKMHNSZRIOD-UHFFFAOYSA-N
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