Cas no 21788-37-4 (1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)-)

1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)- structure
21788-37-4 structure
Product Name:1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)-
CAS No:21788-37-4
MF:C10H16N2O3S
MW:244.310641288757
CID:250196
PubChem ID:5315463
Update Time:2025-07-12

1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)-
    • 5-[(3aR,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid
    • L-BIOTIN
    • 1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, [3aR-(3aa,4b,6aa)]-
    • 1H-Thieno[3,4-d]imidazole-4-valeric acid,hexahydro-2-oxo-, stereoisomer (8CI)
    • AC1NST2B
    • HY-W048449
    • Cambridge id 5192882
    • (3aR,4R,6aS)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic acid
    • 22377-59-9
    • SCHEMBL826595
    • CS-0100427
    • 5-[(3aR, 4R, 6aS)-2-oxo-1, 3, 3a, 4, 6, 6a-hexahydrothieno[3, 4-d]imidazol-4-yl]pentanoic acid
    • 3'-biotin
    • 1H-Thieno[3,4-d]imidazole-4-valeric acid, hexahydro-2-oxo-, stereoisomer (8CI)
    • AKOS025150664
    • 5-[(3aR,4R,6aS)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid
    • DTXSID30415688
    • AS-11756
    • 21788-37-4
    • CHEMBL4782949
    • dl-Biotin
    • Inchi： 1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m1/s1
    • InChI Key： YBJHBAHKTGYVGT-ZXFLCMHBSA-N
    • SMILES： S1C[C@@H]2[C@H]([C@H]1CCCCC(=O)O)NC(N2)=O

Computed Properties

  • Exact Mass: 244.08828
  • Monoisotopic Mass: 244.08816355g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 298
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.3
  • Topological Polar Surface Area: 104?2

Experimental Properties

  • PSA: 78.43

1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)- Pricemore >>

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1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, (3aR,4R,6aS)- Related Literature

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