![3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile structure](/static/products/1845/184530-31-2.webp)
3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile
TL;DR: 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile (CAS 184530-31-2) is a chemical compound with molecular formula C17H13BrN4OS and molecular weight 400.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile
Also Known As: AE-848/33842008, 3,6-diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile, 3,6-diamino-2-[(4-bromophenyl)carbonyl]-4-ethylthieno[2,3-b]pyridine-5-carbonitrile, GNF-Pf-731
| Molecular Formula | C17H13BrN4OS |
|---|---|
| Molecular Weight | 400.00 g/mol |
| LogP | 3.88828 |
| Topological Polar Surface Area | 105.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.99933 |
| Heavy Atoms | 24 |
| Complexity | 1002.33295 |
Chemical Identifiers
| CAS Number | 184530-31-2 |
|---|---|
| SMILES | CCC1=C(C(=NC2=C1C(=C(S2)C(=O)C3=CC=C(C=C3)Br)N)N)C#N |
Product Overview
3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile (CAS 184530-31-2), with molecular formula C17H13BrN4OS and molecular weight 400.00 g/mol. IUPAC: 3,6-diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile.
Chemical Property Profile of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile
Property Insights of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile
The XLogP value of 3.88828 indicates that 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile?
The CAS number of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile is 184530-31-2.
What is the molecular formula of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile?
The molecular formula of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile is C17H13BrN4OS.
What is the molecular weight of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile?
The molecular weight of 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile is 400.00 g/mol.
Where can I buy 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile?
You can request a quote for 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Diamino-2-(4-bromobenzoyl)-4-ethylthieno[2,3-b]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.