6K-056
TL;DR: 6K-056 (CAS 318959-14-7) is a chemical compound with molecular formula C18H13ClF3N7O and molecular weight 435.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyrazol-1-yl]-5-methyl-1,2,4-triazol-4-amine
Also Known As: 6K-056, 3-[5-(3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine, 3-[5-(3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine, 3-[5-[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]pyrazol-1-yl]-5-methyl-1,2,4-triazol-4-amine
| Molecular Formula | C18H13ClF3N7O |
|---|---|
| Molecular Weight | 435.08 g/mol |
| LogP | 4.01252 |
| Topological Polar Surface Area | 96.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.0822 |
| Heavy Atoms | 30 |
| Complexity | 1218.713 |
Chemical Identifiers
| CAS Number | 318959-14-7 |
|---|---|
| SMILES | CC1=NN=C(N1N)N2C(=CC=N2)C3=CC(=CC=C3)OC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
6K-056 (CAS 318959-14-7), with molecular formula C18H13ClF3N7O and molecular weight 435.08 g/mol. IUPAC: 3-[5-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyrazol-1-yl]-5-methyl-1,2,4-triazol-4-amine.
Chemical Property Profile of 6K-056
Property Insights of 6K-056
The XLogP value of 4.01252 indicates that 6K-056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 6K-056. Following Lipinski's Rule of Five, 6K-056 has 1 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 6K-056?
The CAS number of 6K-056 is 318959-14-7.
What is the molecular formula of 6K-056?
The molecular formula of 6K-056 is C18H13ClF3N7O.
What is the molecular weight of 6K-056?
The molecular weight of 6K-056 is 435.08 g/mol.
Where can I buy 6K-056?
You can request a quote for 6K-056 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6K-056?
Yes, KEHONG BIO provides custom synthesis services for 6K-056 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.