Cas no 170456-80-1 (3-Iodo-1-tosylindole)

3-Iodo-1-tosylindole is a versatile heterocyclic compound widely utilized in organic synthesis and pharmaceutical research. Its key structural features include an indole core functionalized with an iodine substituent at the 3-position and a tosyl (p-toluenesulfonyl) group at the 1-position, enhancing its reactivity in cross-coupling reactions such as Suzuki-Miyaura and Sonogashira couplings. The iodine moiety serves as an excellent leaving group, facilitating further derivatization, while the tosyl group provides stability and aids in purification. This compound is particularly valuable in the synthesis of complex indole derivatives, which are prevalent in bioactive molecules and medicinal chemistry. Its well-defined reactivity and stability make it a reliable intermediate for targeted synthetic applications.
3-Iodo-1-tosylindole structure
3-Iodo-1-tosylindole structure
Product Name:3-Iodo-1-tosylindole
CAS No:170456-80-1
MF:C15H12INO2S
MW:397.230754852295
MDL:MFCD13177490
CID:1107532
PubChem ID:10938141
Update Time:2025-06-12

3-Iodo-1-tosylindole Chemical and Physical Properties

Names and Identifiers

    • 3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-Indole
    • 3-Iodo-1-tosyl-1H-indole
    • N-tosyl-3-iodoindole
    • BS-46834
    • 1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]-
    • E82194
    • 3-IODO-1-(4-METHYLBENZENESULFONYL)INDOLE
    • 3-Iodo-1-tosylindole
    • 3-iodo-1-(4-methylphenyl)sulfonylindole
    • SCHEMBL5429439
    • IVAXCXBFLXJZHD-UHFFFAOYSA-N
    • MFCD13177490
    • CS-0179623
    • TQP1280
    • 1h-indole,3-iodo-1-[(4-methylphenyl)sulfonyl]-
    • 1-(Toluene-4-sulfonyl)-3-iodo-indole
    • 3-iodo-1-(toluene-4-sulfonyl)-indole
    • 170456-80-1
    • MDL: MFCD13177490
    • Inchi: 1S/C15H12INO2S/c1-11-6-8-12(9-7-11)20(18,19)17-10-14(16)13-4-2-3-5-15(13)17/h2-10H,1H3
    • InChI Key: IVAXCXBFLXJZHD-UHFFFAOYSA-N
    • SMILES: IC1=CN(C2C=CC=CC=21)S(C1C=CC(C)=CC=1)(=O)=O

Computed Properties

  • Exact Mass: 396.96335g/mol
  • Monoisotopic Mass: 396.96335g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 439
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.2
  • Topological Polar Surface Area: 47.4?2

3-Iodo-1-tosylindole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
I178475-500mg
3-Iodo-1-tosylindole
170456-80-1
500mg
$ 310.00 2022-06-04
TRC
I178475-1000mg
3-Iodo-1-tosylindole
170456-80-1
1g
$ 515.00 2022-06-04
TRC
I178475-2500mg
3-Iodo-1-tosylindole
170456-80-1
2500mg
$ 1030.00 2022-06-04
Matrix Scientific
172816-1g
3-Iodo-1-tosylindole, 95%
170456-80-1 95%
1g
$350.00 2023-09-09
Matrix Scientific
172816-5g
3-Iodo-1-tosylindole, 95%
170456-80-1 95%
5g
$700.00 2023-09-09
Matrix Scientific
172816-10g
3-Iodo-1-tosylindole, 95%
170456-80-1 95%
10g
$1000.00 2023-09-09
eNovation Chemicals LLC
Y1003960-10g
1H-Indole, 3-iodo-1-[(4-Methylphenyl)sulfonyl]-
170456-80-1 95%
10g
$1000 2024-07-24
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1250293-100mg
3-Iodo-1-tosyl-1H-indole
170456-80-1 98%
100mg
¥113 2023-04-15
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1250293-250mg
3-Iodo-1-tosyl-1H-indole
170456-80-1 98%
250mg
¥241 2023-04-15
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1250293-1g
3-Iodo-1-tosyl-1H-indole
170456-80-1 98%
1g
¥628 2023-04-15

Additional information on 3-Iodo-1-tosylindole

Introduction to 3-Iodo-1-tosylindole (CAS No. 170456-80-1)

3-Iodo-1-tosylindole, with the CAS number 170456-80-1, is a versatile compound that has gained significant attention in the fields of medicinal chemistry and organic synthesis. This compound is characterized by its unique structural features, which include an indole core, an iodine substituent, and a tosyl group. These functionalities make it a valuable intermediate in the synthesis of various bioactive molecules and pharmaceuticals.

The indole scaffold is a fundamental building block in the development of numerous drugs due to its biological activity and structural diversity. The presence of the iodine substituent in 3-Iodo-1-tosylindole provides a handle for further functionalization through various chemical transformations, such as cross-coupling reactions. The tosyl group, on the other hand, serves as a good leaving group, facilitating nucleophilic substitution reactions and enabling the synthesis of complex molecules with high efficiency.

Recent advancements in synthetic methodologies have further expanded the utility of 3-Iodo-1-tosylindole. For instance, palladium-catalyzed cross-coupling reactions have been widely employed to introduce a variety of functional groups at the iodine position. This has led to the development of novel compounds with potential therapeutic applications in areas such as oncology, neurology, and cardiovascular diseases.

In addition to its role as a synthetic intermediate, 3-Iodo-1-tosylindole has been explored for its biological activities. Studies have shown that derivatives of this compound exhibit potent inhibitory effects on specific enzymes and receptors, making them promising candidates for drug discovery. For example, certain derivatives have demonstrated selective inhibition of protein kinases, which are key targets in cancer therapy.

The pharmacological properties of 3-Iodo-1-tosylindole and its derivatives have also been investigated in preclinical studies. These studies have provided valuable insights into their mechanism of action, pharmacokinetics, and safety profiles. The results have been encouraging, with several compounds showing favorable pharmacological properties and low toxicity.

Beyond its direct applications in drug discovery, 3-Iodo-1-tosylindole has also found use in other areas of chemical research. For instance, it has been utilized as a starting material for the synthesis of fluorescent probes and imaging agents. These probes are essential tools in cellular and molecular biology, enabling researchers to visualize and study various biological processes with high precision.

The versatility of 3-Iodo-1-tosylindole is further highlighted by its application in combinatorial chemistry. High-throughput screening techniques have been employed to rapidly generate large libraries of compounds derived from this scaffold. This approach has accelerated the identification of lead compounds with desired biological activities, streamlining the drug discovery process.

In conclusion, 3-Iodo-1-tosylindole (CAS No. 170456-80-1) is a highly valuable compound with a wide range of applications in medicinal chemistry and organic synthesis. Its unique structural features and functional groups make it an excellent starting material for the synthesis of bioactive molecules and pharmaceuticals. Ongoing research continues to uncover new possibilities for this compound, solidifying its importance in the scientific community.

Recommended suppliers
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shaanxi pure crystal photoelectric technology co. LTD
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hangzhou Cedareal Technology Co., Ltd.
上海帛亦醫(yī)藥科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Hongxiang Biomedical Technology Co., Ltd.