![1-Bromodithieno[2,3-b:3,4-d]pyridine structure](/static/products/1677/167707-00-8.webp)
1-Bromodithieno[2,3-b:3,4-d]pyridine
TL;DR: 1-Bromodithieno[2,3-b:3,4-d]pyridine (CAS 167707-00-8) is a chemical compound with molecular formula C9H4BrNS2 and molecular weight 268.89685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-4,10-dithia-8-azatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7,11-pentaene
Also Known As: 1-bromodithieno[2,3-b:3,4-d]pyridine, 1-Bromodithieno[2,3-b:3',4'-d]pyridine, 1-Bromodithieno[3,2-d:3/',4/'-f]pyridine, AI-942/42301965, 3-bromo-4,10-dithia-8-azatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7,11-pentaene
Technical Specifications
| Molecular Formula | C9H4BrNS2 |
| Molecular Weight | 268.89685 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 268.89685 Da |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
| SMILES | C1=CSC2=C1C3=C(SC=C3C=N2)Br |
| InChIKey | JAVBFTJFYTUKKL-UHFFFAOYSA-N |
Chemical Property Profile of 1-Bromodithieno[2,3-b:3,4-d]pyridine
Property Insights of 1-Bromodithieno[2,3-b:3,4-d]pyridine
The XLogP value of 4.2 indicates that 1-Bromodithieno[2,3-b:3,4-d]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Bromodithieno[2,3-b:3,4-d]pyridine. Following Lipinski's Rule of Five, 1-Bromodithieno[2,3-b:3,4-d]pyridine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Bromodithieno[2,3-b:3,4-d]pyridine?
The CAS number of 1-Bromodithieno[2,3-b:3,4-d]pyridine is 167707-00-8.
What is the molecular formula of 1-Bromodithieno[2,3-b:3,4-d]pyridine?
The molecular formula of 1-Bromodithieno[2,3-b:3,4-d]pyridine is C9H4BrNS2.
What is the molecular weight of 1-Bromodithieno[2,3-b:3,4-d]pyridine?
The molecular weight of 1-Bromodithieno[2,3-b:3,4-d]pyridine is 268.89685 g/mol.
Where can I buy 1-Bromodithieno[2,3-b:3,4-d]pyridine?
You can request a quote for 1-Bromodithieno[2,3-b:3,4-d]pyridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Bromodithieno[2,3-b:3,4-d]pyridine?
Yes, CoreyChem provides custom synthesis services for 1-Bromodithieno[2,3-b:3,4-d]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.