![3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide structure](/static/products/488/488802-67-1.png)
3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide
TL;DR: 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide (CAS 488802-67-1) is a chemical compound with molecular formula C17H12F3N5OS and molecular weight 391.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diamino-5-cyano-N-[[4-(trifluoromethyl)phenyl]methyl]thieno[2,3-b]pyridine-2-carboxamide
Also Known As: 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide, 3,6-diamino-5-cyano-N-[4-(trifluoromethyl)benzyl]thieno[2,3-b]pyridine-2-carboxamide, 3,6-diamino-5-cyano-N-[[4-(trifluoromethyl)phenyl]methyl]thieno[2,3-b]pyridine-2-carboxamide
| Molecular Formula | C17H12F3N5OS |
|---|---|
| Molecular Weight | 391.07 g/mol |
| LogP | 3.28118 |
| Topological Polar Surface Area | 117.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.07147 |
| Heavy Atoms | 27 |
| Complexity | 1067.338 |
Chemical Identifiers
| CAS Number | 488802-67-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=O)C2=C(C3=C(S2)N=C(C(=C3)C#N)N)N)C(F)(F)F |
Product Overview
3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide (CAS 488802-67-1), with molecular formula C17H12F3N5OS and molecular weight 391.07 g/mol. IUPAC: 3,6-diamino-5-cyano-N-[[4-(trifluoromethyl)phenyl]methyl]thieno[2,3-b]pyridine-2-carboxamide.
Chemical Property Profile of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide
Property Insights of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide
The XLogP value of 3.28118 indicates that 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide. Following Lipinski's Rule of Five, 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide has 3 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-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide?
The CAS number of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide is 488802-67-1.
What is the molecular formula of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide?
The molecular formula of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide is C17H12F3N5OS.
What is the molecular weight of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide?
The molecular weight of 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide is 391.07 g/mol.
Where can I buy 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide?
You can request a quote for 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide 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-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,6-diamino-5-cyano-N-(4-(trifluoromethyl)benzyl)thieno[2,3-b]pyridine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.