6K-035
TL;DR: 6K-035 (CAS 400085-53-2) is a chemical compound with molecular formula C15H11F3N4O2S2 and molecular weight 400.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[3-(furan-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]-3-methylthiourea
Also Known As: 6K-035, 2-{[3-(2-furyl)-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]carbonyl}-N-methyl-1-hydrazinecarbothioamide, 1-[[3-(furan-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]-3-methylthiourea, 3-(furan-2-yl)-N-[(methylcarbamothioyl)amino]-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxamide
| Molecular Formula | C15H11F3N4O2S2 |
|---|---|
| Molecular Weight | 400.03 g/mol |
| LogP | 3.3138 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 400.02756 |
| Heavy Atoms | 26 |
| Complexity | 967.33575 |
Chemical Identifiers
| CAS Number | 400085-53-2 |
|---|---|
| SMILES | CNC(=S)NNC(=O)C1=C(C2=C(S1)C=C(C=N2)C(F)(F)F)C3=CC=CO3 |
Product Overview
6K-035 (CAS 400085-53-2), with molecular formula C15H11F3N4O2S2 and molecular weight 400.03 g/mol. IUPAC: 1-[[3-(furan-2-yl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]-3-methylthiourea.
Chemical Property Profile of 6K-035
Property Insights of 6K-035
The XLogP value of 3.3138 indicates that 6K-035 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 6K-035. Following Lipinski's Rule of Five, 6K-035 has 3 hydrogen bond donor(s) and 5 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 6K-035?
The CAS number of 6K-035 is 400085-53-2.
What is the molecular formula of 6K-035?
The molecular formula of 6K-035 is C15H11F3N4O2S2.
What is the molecular weight of 6K-035?
The molecular weight of 6K-035 is 400.03 g/mol.
Where can I buy 6K-035?
You can request a quote for 6K-035 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6K-035?
Yes, KEHONG BIO provides custom synthesis services for 6K-035 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.