![4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol structure](/static/products/4614/461438-44-8.webp)
4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol
TL;DR: 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol (CAS 461438-44-8) is a chemical compound with molecular formula C12H9BrN2O2S and molecular weight 323.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol
Also Known As: 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol, 4-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-ol, 4-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]thio}but-2-yn-1-ol, A3244/0137790, 4-((5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl)thio)but-2-yn-1-ol
| Molecular Formula | C12H9BrN2O2S |
|---|---|
| Molecular Weight | 323.96 g/mol |
| LogP | 2.5869 |
| Topological Polar Surface Area | 59.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.95682 |
| Heavy Atoms | 18 |
| Complexity | 571.7536 |
Chemical Identifiers
| CAS Number | 461438-44-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=C(O2)SCC#CCO)Br |
Product Overview
4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol (CAS 461438-44-8), with molecular formula C12H9BrN2O2S and molecular weight 323.96 g/mol. IUPAC: 4-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol.
Chemical Property Profile of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol
Property Insights of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol
The XLogP value of 2.5869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol. With a topological polar surface area (TPSA) of 59.15 Ų, 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol has 1 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 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol?
The CAS number of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol is 461438-44-8.
What is the molecular formula of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol?
The molecular formula of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol is C12H9BrN2O2S.
What is the molecular weight of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol?
The molecular weight of 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol is 323.96 g/mol.
Where can I buy 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol?
You can request a quote for 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.