2-(4-Chlorophenyl)-4-[(3S)-3-Piperidinylamino]Thieno[2,3-D]Pyridazine-7-Carboxamide

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Properties Simple | Detailed

Formula C18H18ClN5OS
IUPAC Name 2-(4-chlorophenyl)-4-[[(3s)-3-piperidyl]amino]thieno[2,3-d]pyridazine-7-carboxamide
Molecular Mass 387.886 g·mol−1
Heat of Formation 161.0 ± 16.7 kJ·mol−1
Dipole Moment 6.24 ± 1.08 D
Volume 422.61 Å 3
Surface Area 381.54 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 1.62 ± eV
Point Group Symmetry C1
InChIKey OIVCIDIQAWPEAZ-LBPRGKRZSA-N
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Elements C Cl H O N S