Benzyl (3R)-3-(Hydroxycarbamoyl)-4-[(4-Methoxyphenyl)Sulfonyl]-1-Piperazinecarboxylate

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Properties Simple | Detailed

Formula C20H23N3O7S
IUPAC Name benzyl (3r,4r)-3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxylate
Molecular Mass 449.478 g·mol−1
Heat of Formation -855.0 ± 16.7 kJ·mol−1
Dipole Moment 6.67 ± 1.08 D
Volume 492.17 Å 3
Surface Area 407.31 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxylic acid benzyl ester
  • (3r)-3-[(hydroxyamino)-oxomethyl]-4-(4-methoxyphenyl)sulfonyl-1-piperazinecarboxylic acid phenylmethyl ester
  • n-hydroxy-1-(4-methoxyphenyl)sulfonyl-4-benzyloxycarbonyl-piperazine-2-carboxamide
  • phenylmethyl (3r)-3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxylate
  • phenylmethyl (3r)-3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonylpiperazine-1-carboxylate
  • spi
InChIKey DNGGPLKVDUPXFN-GOSISDBHSA-N
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