AC1N4CZ9 structure

AC1N4CZ9

N-(2-methylsulfonylsulfanylethyl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide

Also Known As: N-Biotinylcaproylaminoethyl Methanethiosulfonate|N-(2-methylsulfonylsulfanylethyl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide

CAS: 353754-95-7
Molecular Formula C19H34N4O5S3
Molecular Weight 494.16913 g/mol
LogP 1.1978
Topological Polar Surface Area 133.47 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 15
Exact Mass 494.16913
Monoisotopic Mass 494.16913
Heavy Atoms 31
Complexity 719.3318

Chemical Identifiers

CAS Number 353754-95-7
SMILES CS(=O)(=O)SCCNC(=O)CCCCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2

Product Overview

AC1N4CZ9 (CAS 353754-95-7), with molecular formula C19H34N4O5S3 and molecular weight 494.16913 g/mol. IUPAC: N-(2-methylsulfonylsulfanylethyl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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