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

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Formula C12H22N4O2S
IUPAC Name 5-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-n-(2-aminoethyl)pentanamide
Molecular Mass 286.394 g·mol−1
Heat of Formation -404.7 ± 16.7 kJ·mol−1
Dipole Moment 5.69 ± 1.08 D
Volume 350.66 Å 3
Surface Area 322.85 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy -0.49 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-thieno(3,4-d)imidazole-4-pentanamide, n-(2-aminoethyl)hexahydro-3-oxo-, (3as,4s,6ar)-
  • 5-[(3ar,6s,6as)-2-keto-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-6-yl]-n-(2-aminoethyl)valeramide
  • 5-[(3ar,6s,6as)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-6-yl]-n-(2-aminoethyl)pentanamide
  • baea
  • biotinylamidoethylacetamide
CAS Number(s)
  • 111790-37-5
InChIKey BNCJEZWKLUBUBB-QXEWZRGKSA-N
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