4-(4-(N,N-Dimethyl-Sulfamoyl)Piperazino)-2-Hydroxymethylpyrimidine

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Properties Simple | Detailed

Formula C11H19N5O3S
IUPAC Name 4-[2-(hydroxymethyl)pyrimidin-4-yl]-n,n-dimethyl-piperazine-1-sulfonamide
Molecular Mass 301.365 g·mol−1
Heat of Formation -344.3 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 344.67 Å 3
Surface Area 306.26 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.57 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxymethyl-4-(4-(n,n-dimethylaminosulfonyl)-1-piperazino)pyrimidine
  • 4-[2-(hydroxymethyl)-4-pyrimidinyl]-n,n-dimethyl-1-piperazinesulfonamide
  • 4-[2-(hydroxymethyl)pyrimidin-4-yl]-n,n-dimethyl-piperazine-1-sulfonamide
  • 4-[2-(hydroxymethyl)pyrimidin-4-yl]-n,n-dimethylpiperazine-1-sulfonamide
  • cp-166,572
  • cp-166572, 2-hydroxymethyl-4-(4-n,n-dimethylaminosulfonyl-1-piperazino)-pyrimidine
  • n,n-dimethyl-4-(2-methylolpyrimidin-4-yl)piperazine-1-sulfonamide
  • sdi-2 cpd
  • way 135706
  • way-135706
CAS Number(s)
  • 140687-51-0
InChIKey XDTHNROWHAAVPJ-UHFFFAOYSA-N
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