3-Amino-5-Chloro-N-Cyclopropyl-4-Methyl-6-[2-(4-Methyl-1-Piperazinyl)-2-Oxoethoxy]Thieno[2,3-B]Pyridine-2-Carboxamide

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Properties Simple | Detailed

Formula C19H24ClN5O3S
IUPAC Name 3-amino-5-chloro-n-cyclopropyl-4-methyl-6-[2-(4-methylpiperazin-1-yl)-2-oxo-ethoxy]thieno[2,3-b]pyridine-2-carboxamide
Molecular Mass 437.944 g·mol−1
Heat of Formation -283.5 ± 16.7 kJ·mol−1
Dipole Moment 2.12 ± 1.08 D
Volume 485.53 Å 3
Surface Area 431.8 Å 2
HOMO Energy -8.26 ± 0.55 eV
LUMO Energy 1.93 ± eV
Point Group Symmetry C1
InChIKey TYTGOXSAAQWLPJ-UHFFFAOYSA-N
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Elements C Cl H O N S