(3R)-6-Chloro-3-(Cyclopentylmethyl)-3,4-Dihydro-2H-1,2,4-Benzothiadiazine-7-Sulfonamide 1,1-Dioxide

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Properties Simple | Detailed

Formula C13H18ClN3O4S2
IUPAC Name (3r)-6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2h-1λ6,2,4-benzothiadiazine-7-sulfonamide
Molecular Mass 379.883 g·mol−1
Heat of Formation -655.3 ± 16.7 kJ·mol−1
Dipole Moment 8.89 ± 1.08 D
Volume 391.29 Å 3
Surface Area 344.84 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-6-chloro-3-(cyclopentylmethyl)-1,1-diketo-3,4-dihydro-2h-benzo[e][1,2,4]thiadiazine-7-sulfonamide
  • (3r)-6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2h-benzo[e][1,2,4]thiadiazine-7-sulfonamide
InChIKey BKYKPTRYDKTTJY-CYBMUJFWSA-N
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