![5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole structure](/static/products/5001/500112-04-9.webp)
5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole
TL;DR: 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole (CAS 500112-04-9) is a chemical compound with molecular formula C14H10Cl2N4S and molecular weight 336.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenyltetrazole
Also Known As: 5-[(3,4-dichlorobenzyl)sulfanyl]-1-phenyl-1H-tetrazole, 5-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenyltetrazole, 5-[(3,4-dichlorophenyl)methylthio]-1-phenyl-1,2,3,4-tetraazole, 5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole
| Molecular Formula | C14H10Cl2N4S |
|---|---|
| Molecular Weight | 336.00 g/mol |
| LogP | 4.2614 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.00034 |
| Heavy Atoms | 21 |
| Complexity | 745.73975 |
Chemical Identifiers
| CAS Number | 500112-04-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole (CAS 500112-04-9), with molecular formula C14H10Cl2N4S and molecular weight 336.00 g/mol. IUPAC: 5-[(3,4-dichlorophenyl)methylsulfanyl]-1-phenyltetrazole.
Chemical Property Profile of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole
Property Insights of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole
The XLogP value of 4.2614 indicates that 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole 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-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole?
The CAS number of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole is 500112-04-9.
What is the molecular formula of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole?
The molecular formula of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole is C14H10Cl2N4S.
What is the molecular weight of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole?
The molecular weight of 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole is 336.00 g/mol.
Where can I buy 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole?
You can request a quote for 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(3,4-Dichlorophenyl)methylsulfanyl]-1-phenyltetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.