![3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one structure](/static/products/6944/694485-88-6.webp)
3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one
TL;DR: 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one (CAS 694485-88-6) is a chemical compound with molecular formula C12H9BrN2O3S and molecular weight 339.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one
Also Known As: 3-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one, AP-853/42160174, 3-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]thio}dihydro-2(3H)-furanone, 3-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}dihydrofuran-2(3H)-one, 3-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]-2-oxolanone
| Molecular Formula | C12H9BrN2O3S |
|---|---|
| Molecular Weight | 339.95 g/mol |
| LogP | 2.9067 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.95172 |
| Heavy Atoms | 19 |
| Complexity | 599.2769 |
Chemical Identifiers
| CAS Number | 694485-88-6 |
|---|---|
| SMILES | C1COC(=O)C1SC2=NN=C(O2)C3=CC=C(C=C3)Br |
Product Overview
3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one (CAS 694485-88-6), with molecular formula C12H9BrN2O3S and molecular weight 339.95 g/mol. IUPAC: 3-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one.
Chemical Property Profile of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one
Property Insights of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one
The XLogP value of 2.9067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one. The TPSA of 65.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one. Following Lipinski's Rule of Five, 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one has 0 hydrogen bond donor(s) and 6 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 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one?
The CAS number of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one is 694485-88-6.
What is the molecular formula of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one?
The molecular formula of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one is C12H9BrN2O3S.
What is the molecular weight of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one?
The molecular weight of 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one is 339.95 g/mol.
Where can I buy 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one?
You can request a quote for 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.