1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole
TL;DR: 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole (CAS 338967-98-9) is a chemical compound with molecular formula C11H12Cl2N4OS and molecular weight 318.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichloro-5-propan-2-yloxyphenyl)-5-methylsulfanyltetrazole
Also Known As: 6L-600S, 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole, 1-(2,4-dichloro-5-propan-2-yloxyphenyl)-5-methylsulfanyltetrazole, 1-[2,4-dichloro-5-(propan-2-yloxy)phenyl]-5-(methylsulfanyl)-1H-1,2,3,4-tetrazole, 1-(2,4-dichloro-5-propan-2-yloxy-phenyl)-5-methylsulfanyl-tetrazole
| Molecular Formula | C11H12Cl2N4OS |
|---|---|
| Molecular Weight | 318.01 g/mol |
| LogP | 3.4782 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.0109 |
| Heavy Atoms | 19 |
| Complexity | 588.06934 |
Chemical Identifiers
| CAS Number | 338967-98-9 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C(=C1)N2C(=NN=N2)SC)Cl)Cl |
Product Overview
1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole (CAS 338967-98-9), with molecular formula C11H12Cl2N4OS and molecular weight 318.01 g/mol. IUPAC: 1-(2,4-dichloro-5-propan-2-yloxyphenyl)-5-methylsulfanyltetrazole.
Chemical Property Profile of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole
Property Insights of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole
The XLogP value of 3.4782 indicates that 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.83 Ų, 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole has 0 hydrogen bond donor(s) and 5 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-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole?
The CAS number of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole is 338967-98-9.
What is the molecular formula of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole?
The molecular formula of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole is C11H12Cl2N4OS.
What is the molecular weight of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole?
The molecular weight of 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole is 318.01 g/mol.
Where can I buy 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole?
You can request a quote for 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-dichloro-5-isopropoxyphenyl)-5-(methylsulfanyl)-1H-1,2,3,4-tetraazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.