N-(4-{[4-(1-Pyrrolidinyl)-1-Piperidinyl]Sulfonyl}Benzyl)-2H-Pyrido[4,3-E][1,2,4]Thiadiazin-3-Amine 1,1-Dioxide

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Properties Simple | Detailed

Formula C22H28N6O4S2
IUPAC Name 1,1-dioxo-n-[[4-[(4-pyrrolidin-1-yl-1-piperidyl)sulfonyl]phenyl]methyl]-2h-pyrido[4,3-e][1,2,4]thiadiazin-3-amine
Molecular Mass 504.626 g·mol−1
Heat of Formation -354.9 ± 16.7 kJ·mol−1
Dipole Moment 7.30 ± 1.08 D
Volume 558.88 Å 3
Surface Area 480.0 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
InChIKey BCPZRYGPLBZKEZ-UHFFFAOYSA-N
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