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B-428 structure
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B-428

TL;DR: B-428 (CAS 154628-42-9) is a chemical compound with molecular formula C9H7IN2S and molecular weight 301.93747 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-iodo-1-benzothiophene-2-carboximidamide

4-iodo-1-benzothiophene-2-carboximidamide

Also Known As: 1c5x, 4-iodo-1-benzothiophene-2-carboximidamide, 1c5n, 1c5q, 1o5b

CAS Number
154628-42-9
Molecular Formula
C9H7IN2S
Molecular Weight
301.93747 g/mol
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Application Areas

Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (2 patents) Biotechnology (1 patents) Heterocyclic Building Blocks (2 patents) Organic Building Blocks (1 patents) Peptides & Amino Acids (6 patents)

Technical Specifications

Molecular FormulaC9H7IN2S
Molecular Weight301.93747 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)78.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass301.93747 Da
Heavy Atoms13
Complexity222.0
SMILESC1=CC2=C(C=C(S2)C(=N)N)C(=C1)I
InChIKeyYERQOXAYAFWFEJ-UHFFFAOYSA-N

Product Description

Applications: B-428 is used in pharmaceutical synthesis routes and API production, as well as peptide synthesis and amino acid derivative chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

B-428 (CAS 154628-42-9) is a pharmaceutical intermediate with the molecular formula C9H7IN2S and a molecular weight of 301.94 g/mol. Synonyms include 1c5x and 4-iodo-1-benzothiophene-2-carboximidamide.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of B-428

XLogP
2.9
TPSA (Topological Polar Surface Area)
78.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
13
Complexity
222.0
Exact Mass
301.93747
Monoisotopic Mass
301.93747
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of B-428

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for B-428. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for B-428. Following Lipinski's Rule of Five, B-428 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of B-428?

The CAS number of B-428 is 154628-42-9.

What is the molecular formula of B-428?

The molecular formula of B-428 is C9H7IN2S.

What is the molecular weight of B-428?

The molecular weight of B-428 is 301.93747 g/mol.

What are the applications of B-428?

B-428 is used in pharmaceutical synthesis routes and API production, as well as peptide synthesis and amino acid derivative chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton...

Where can I buy B-428?

You can request a quote for B-428 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for B-428?

Yes, CoreyChem provides custom synthesis services for B-428 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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