![4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol structure](/static/products/4780/478063-34-2.webp)
4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol
TL;DR: 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol (CAS 478063-34-2) is a chemical compound with molecular formula C19H26N2OS2 and molecular weight 362.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)phenol
Also Known As: Bionet1_003733, 4-[5-(allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol, 6P-526S, 2,6-di-tert-butyl-4-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]phenol, 2,6-ditert-butyl-4-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)phenol
| Molecular Formula | C19H26N2OS2 |
|---|---|
| Molecular Weight | 362.15 g/mol |
| LogP | 5.7838 |
| Topological Polar Surface Area | 46.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.14865 |
| Heavy Atoms | 24 |
| Complexity | 701.55066 |
Chemical Identifiers
| CAS Number | 478063-34-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=NN=C(S2)SCC=C |
Product Overview
4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol (CAS 478063-34-2), with molecular formula C19H26N2OS2 and molecular weight 362.15 g/mol. IUPAC: 2,6-ditert-butyl-4-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)phenol.
Chemical Property Profile of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol
Property Insights of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol
The XLogP value of 5.7838 indicates that 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.01 Ų, 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol?
The CAS number of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol is 478063-34-2.
What is the molecular formula of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol?
The molecular formula of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol is C19H26N2OS2.
What is the molecular weight of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol?
The molecular weight of 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol is 362.15 g/mol.
Where can I buy 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol?
You can request a quote for 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[5-(Allylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,6-di(tert-butyl)benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.