N-(2-Hydroxyethyl)-5-[(3As,4S,6Ar)-2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl]Pentanamide

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Properties Simple | Detailed

Formula C12H21N3O3S
IUPAC Name 5-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-n-(2-hydroxyethyl)pentanamide
Molecular Mass 287.378 g·mol−1
Heat of Formation -612.4 ± 16.7 kJ·mol−1
Dipole Moment 5.34 ± 1.08 D
Volume 346.29 Å 3
Surface Area 288.85 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(biotinylamido)ethanol
  • 2-bae
  • 5-[(3ar,6s,6as)-2-keto-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-6-yl]-n-(2-hydroxyethyl)valeramide
CAS Number(s)
  • 95611-10-2
InChIKey UYBGABATOCWMIE-QXEWZRGKSA-N
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