![5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole structure](/static/products/4000/400080-91-3.webp)
5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole
TL;DR: 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole (CAS 400080-91-3) is a chemical compound with molecular formula C19H20N2S2 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-tert-butylphenyl)methylsulfanyl]-4-phenylthiadiazole
Also Known As: 3H-343S, 5-[(4-tert-butylphenyl)methylsulfanyl]-4-phenylthiadiazole, 5-{[4-(tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole, 5-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole, 4-phenyl-5-[(4-tert-butylphenyl)methylsulfanyl]thiadiazole
| Molecular Formula | C19H20N2S2 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 5.7949 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.10678 |
| Heavy Atoms | 23 |
| Complexity | 756.06866 |
Chemical Identifiers
| CAS Number | 400080-91-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CSC2=C(N=NS2)C3=CC=CC=C3 |
Product Overview
5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole (CAS 400080-91-3), with molecular formula C19H20N2S2 and molecular weight 340.11 g/mol. IUPAC: 5-[(4-tert-butylphenyl)methylsulfanyl]-4-phenylthiadiazole.
Chemical Property Profile of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole
Property Insights of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole
The XLogP value of 5.7949 indicates that 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole?
The CAS number of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole is 400080-91-3.
What is the molecular formula of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole?
The molecular formula of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole is C19H20N2S2.
What is the molecular weight of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole?
The molecular weight of 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole is 340.11 g/mol.
Where can I buy 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole?
You can request a quote for 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-{[4-(Tert-butyl)benzyl]sulfanyl}-4-phenyl-1,2,3-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.