7K-006
TL;DR: 7K-006 (CAS 478066-08-9) is a chemical compound with molecular formula C14H7F3N4S3 and molecular weight 383.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]-1,2-dihydro-1,2,4-triazole-3-thione
Also Known As: 7K-006, 5-[3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]-4H-1,2,4-triazole-3-thiol, 5-[3-(thiophen-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]-4H-1,2,4-triazole-3-thiol, 5-[3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]-1,2-dihydro-1,2,4-triazole-3-thione, 1,2-Dihydro-5-[3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]-3H-1,2,4-triazole-3-thione
| Molecular Formula | C14H7F3N4S3 |
|---|---|
| Molecular Weight | 383.98 g/mol |
| LogP | 5.49129 |
| Topological Polar Surface Area | 57.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 383.9785 |
| Heavy Atoms | 24 |
| Complexity | 1073.0176 |
Chemical Identifiers
| CAS Number | 478066-08-9 |
|---|---|
| SMILES | C1=CSC(=C1)C2=C(SC3=C2N=CC(=C3)C(F)(F)F)C4=NC(=S)NN4 |
Product Overview
7K-006 (CAS 478066-08-9), with molecular formula C14H7F3N4S3 and molecular weight 383.98 g/mol. IUPAC: 5-[3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]-1,2-dihydro-1,2,4-triazole-3-thione.
Chemical Property Profile of 7K-006
Property Insights of 7K-006
The XLogP value of 5.49129 indicates that 7K-006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.36 Ų, 7K-006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7K-006 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7K-006?
The CAS number of 7K-006 is 478066-08-9.
What is the molecular formula of 7K-006?
The molecular formula of 7K-006 is C14H7F3N4S3.
What is the molecular weight of 7K-006?
The molecular weight of 7K-006 is 383.98 g/mol.
Where can I buy 7K-006?
You can request a quote for 7K-006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7K-006?
Yes, KEHONG BIO provides custom synthesis services for 7K-006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.