5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole
TL;DR: 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole (CAS 896843-84-8) is a chemical compound with molecular formula C6H8Cl2N4S and molecular weight 237.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,2-dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole
Also Known As: 5-[(2,2-dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole, 5-{[(2,2-dichlorocyclopropyl)methyl]sulfanyl}-1-methyl-1H-tetraazole, AP-853/43260380, 5-(((2,2-dichlorocyclopropyl)methyl)thio)-1-methyl-1H-tetrazole, 5-{[(2,2-dichlorocyclopropyl)methyl]sulfanyl}-1-methyl-1H-tetrazole
| Molecular Formula | C6H8Cl2N4S |
|---|---|
| Molecular Weight | 237.98 g/mol |
| LogP | 1.496 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.98468 |
| Heavy Atoms | 13 |
| Complexity | 313.33783 |
Chemical Identifiers
| CAS Number | 896843-84-8 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC2CC2(Cl)Cl |
Product Overview
5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole (CAS 896843-84-8), with molecular formula C6H8Cl2N4S and molecular weight 237.98 g/mol. IUPAC: 5-[(2,2-dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole.
Chemical Property Profile of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole
Property Insights of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole
The XLogP value of 1.496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole. With a topological polar surface area (TPSA) of 43.6 Ų, 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole 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-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole?
The CAS number of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole is 896843-84-8.
What is the molecular formula of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole?
The molecular formula of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole is C6H8Cl2N4S.
What is the molecular weight of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole?
The molecular weight of 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole is 237.98 g/mol.
Where can I buy 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole?
You can request a quote for 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2,2-Dichlorocyclopropyl)methylsulfanyl]-1-methyltetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.