![1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole structure](/static/products/898/898645-35-7.png)
1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole
TL;DR: 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole (CAS 898645-35-7) is a chemical compound with molecular formula C16H11F3N8S and molecular weight 404.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-5-[[1-[3-(trifluoromethyl)phenyl]tetrazol-5-yl]methylsulfanyl]tetrazole
Also Known As: 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole, 1-phenyl-5-(((1-(3-(trifluoromethyl)phenyl)-1H-tetrazol-5-yl)methyl)thio)-1H-tetrazole, 1-phenyl-5-[[1-[3-(trifluoromethyl)phenyl]tetrazol-5-yl]methylsulfanyl]tetrazole, 1-phenyl-5-({1-[3-(trifluoromethyl)phenyl](1,2,3,4-tetraazol-5-yl)}methylthio) -1,2,3,4-tetraazole
| Molecular Formula | C16H11F3N8S |
|---|---|
| Molecular Weight | 404.08 g/mol |
| LogP | 2.9491 |
| Topological Polar Surface Area | 87.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.07794 |
| Heavy Atoms | 28 |
| Complexity | 1076.7002 |
Chemical Identifiers
| CAS Number | 898645-35-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NN=NN3C4=CC=CC(=C4)C(F)(F)F |
Product Overview
1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole (CAS 898645-35-7), with molecular formula C16H11F3N8S and molecular weight 404.08 g/mol. IUPAC: 1-phenyl-5-[[1-[3-(trifluoromethyl)phenyl]tetrazol-5-yl]methylsulfanyl]tetrazole.
Chemical Property Profile of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole
Property Insights of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole
The XLogP value of 2.9491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole. Following Lipinski's Rule of Five, 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole has 0 hydrogen bond donor(s) and 7 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 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole?
The CAS number of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole is 898645-35-7.
What is the molecular formula of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole?
The molecular formula of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole is C16H11F3N8S.
What is the molecular weight of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole?
The molecular weight of 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole is 404.08 g/mol.
Where can I buy 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole?
You can request a quote for 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-5-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.