![5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole structure](/static/products/5685/568559-41-1.webp)
5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole
TL;DR: 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole (CAS 568559-41-1) is a chemical compound with molecular formula C10H10F2N4S and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(difluoromethylsulfanyl)-1-(2,4-dimethylphenyl)tetrazole
Also Known As: 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole, 5-(difluoromethylsulfanyl)-1-(2,4-dimethylphenyl)tetrazole, 5-[(Difluoromethyl)sulfanyl]-1-(2,4-dimethylphenyl)-1H-tetrazole
| Molecular Formula | C10H10F2N4S |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 2.59384 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.05942 |
| Heavy Atoms | 17 |
| Complexity | 526.7745 |
Chemical Identifiers
| CAS Number | 568559-41-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=NN=N2)SC(F)F)C |
Product Overview
5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole (CAS 568559-41-1), with molecular formula C10H10F2N4S and molecular weight 256.06 g/mol. IUPAC: 5-(difluoromethylsulfanyl)-1-(2,4-dimethylphenyl)tetrazole.
Chemical Property Profile of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole
Property Insights of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole
The XLogP value of 2.59384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole. With a topological polar surface area (TPSA) of 43.6 Ų, 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole has 0 hydrogen bond donor(s) and 4 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 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole?
The CAS number of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole is 568559-41-1.
What is the molecular formula of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole?
The molecular formula of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole is C10H10F2N4S.
What is the molecular weight of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole?
The molecular weight of 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole is 256.06 g/mol.
Where can I buy 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole?
You can request a quote for 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Difluoromethyl)thio]-1-(2,4-dimethylphenyl)-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.