Taprenepag

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Properties Simple | Detailed

Formula C24H22N4O5S
IUPAC Name 2-[3-[[(4-pyrazol-1-ylphenyl)methyl-(3-pyridylsulfonyl)amino]methyl]phenoxy]acetic acid
Molecular Mass 478.520 g·mol−1
Heat of Formation -326.6 ± 16.7 kJ·mol−1
Dipole Moment 6.61 ± 1.08 D
Volume 531.61 Å 3
Surface Area 409.17 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[3-[[(4-pyrazol-1-ylbenzyl)-(3-pyridylsulfonyl)amino]methyl]phenoxy]acetic acid
  • 2-[3-[[(4-pyrazol-1-ylphenyl)methyl-(3-pyridylsulfonyl)amino]methyl]phenoxy]acetic acid
  • 2-[3-[[(4-pyrazol-1-ylphenyl)methyl-pyridin-3-ylsulfonyl-amino]methyl]phenoxy]ethanoic acid
  • 2-[3-[[[4-(1-pyrazolyl)phenyl]methyl-(3-pyridylsulfonyl)amino]methyl]phenoxy]acetic acid
InChIKey MFFBXYNKZHTCEY-UHFFFAOYSA-N
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