7-Chloro-3-(4-Methyl-1-Piperazinyl)-2H-1,2,4-Benzothiadiazine-1,1-Dioxide

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Properties Simple | Detailed

Formula C12H15ClN4O2S
IUPAC Name 7-chloro-3-(4-methylpiperazin-1-yl)-4h-1λ6,2,4-benzothiadiazine 1,1-dioxide
Molecular Mass 314.791 g·mol−1
Heat of Formation -135.9 ± 16.7 kJ·mol−1
Dipole Moment 9.21 ± 1.08 D
Volume 333.45 Å 3
Surface Area 303.78 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1,2,4-benzothiadiazine, 7-chloro-3-(4-methyl-1-piperazinyl)-, 1,1-dioxide
  • 7-chloro-3-(4-methyl-1-piperazinyl)-4h-1,2,4-benzothiadiazine 1,1-dioxide
  • 7-chloro-3-(4-methyl-1-piperazinyl)-4h-1,2,4-benzothiadiazine-1,1-dioxide
  • 7-chloro-3-(4-methyl-1-piperazinyl)-4h-benzo[e][1,2,4]thiadiazine 1,1-dioxide
  • 7-chloro-3-(4-methylpiperazin-1-yl)-4h-benzo[e][1,2,4]thiadiazine 1,1-dioxide
  • du 717
  • du-717
CAS Number(s)
  • 59943-31-6
InChIKey JPZVJONKWYICFB-UHFFFAOYSA-N
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