N-{6-[(Iodoacetyl)amino]hexyl}-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide

Basic Information

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CAS Number

93285-75-7

Molecular Formula

C18H31IN4O3S

Molecular Weight

510.44 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Density

1.414±0.06 g/cm3 (20 ºC 760 Torr),

Solubility

Insuluble (2.4E-3 g/L) (25 ºC),

SMILES

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C1C2C(C(S1)CCCCC(=O)NCCCCCCNC(=O)CI)NC(=O)N2

InChI

InChI=1S/C18H31IN4O3S/c19-11-16(25)21-10-6-2-1-5-9-20-15(24)8-4-3-7-14-17-13(12-27-14)22-18(26)23-17/h13-14,17H,1-12H2,(H,20,24)(H,21,25)(H2,22,23,26)/t13-,14-,17-/m0/s1

InChIKey

DNXDWMHPTVQBIP-ZQIUZPCESA-N

LogP

1.94

Topological Polar Surface Area

99.33000000000001 Å²

Hydrogen Bond Donor/Acceptor

4 / 7

Complexity

509

Synonyms & References

English

93285-75-7
AKOS015894734
BP-22638
N-Biotinyl-N'-(iodoacetyl)-1,6-hexanediamine
1H-Thieno(3,4-d)imidazole-4-pentanamide, hexahydro-N-(6-((iodoacetyl)amino)hexyl)-2-oxo-, (3aS-(3aalpha,4beta,6aalpha))-
DTXSID90918564
Iaa-biotin
SCHEMBL1035258
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[6-[(2-iodoacetyl)amino]hexyl]pentanamide
HY-138065
N-{6-[(1-Hydroxy-2-iodoethylidene)amino]hexyl}-5-(2-hydroxy-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-6-yl)pentanimidic acid
DNXDWMHPTVQBIP-ZQIUZPCESA-N
N-(6-(2-iodoacetamido)hexyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
CS-0144227
N-Iodoacetyl-N'-biotinylhexylenediamine
Iodoacetyl-LC-Biotin
iodoacetyl-LC biotin
N-IODOACETYL-N-BIOTINYLHEXYLENEDIAMINE
Iodoacetyl LC Biotin
N-Biotinyl-N’-(iodoacetyl)-1,6-hexanediamine
iodoacetyl-LC-biotin
N-Iodoacetyl-N'-biotinyl-1,6-hexanediamine
N-IODOACETYL-N'-BIOTINYLHEXYLENEDIAMINE
(3aS,4S,6aR)-Hexahydro-N-[6-[(iodoacetyl)amino]hexyl]-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide

MDL Number

MFCD00054987

FAQ

What is N-{6-[(Iodoacetyl)amino]hexyl}-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (CAS: 93285-75-7)?

This compound is a complex organic molecule with a specific structure. It features a thienoimidazole moiety and an iodoacetyl amino hexyl side chain. It is used in various applications including pharmaceuticals and research due to its unique chemical properties.

What are the main uses of N-{6-[(Iodoacetyl)amino]hexyl}-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (CAS: 93285-75-7)?

This compound is primarily used in pharmaceutical research and development for its pharmacological properties. It also has potential applications in analytical chemistry and as a reagent in biochemistry.

Is N-{6-[(Iodoacetyl)amino]hexyl}-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (CAS: 93285-75-7) safe?

This compound should be handled with caution due to its chemical nature. Proper personal protective equipment, including gloves and goggles, should be worn. It should be stored away from heat and light, and in a cool, dry place. Immediate medical attention is advised in case of accidental ingestion or exposure.

How should N-{6-[(Iodoacetyl)amino]hexyl}-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (CAS: 93285-75-7) be stored?

This compound should be stored in a cool, dry place, away from direct sunlight and heat sources. It must be kept in a tightly sealed container to prevent contamination and degradation. Proper labeling and regular inspection for stability are recommended.