2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
TL;DR: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide (CAS 5392-49-4) is a chemical compound with molecular formula C17H12BrF2N3O3S and molecular weight 454.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
Also Known As: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide, 2-{[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-[4-(difluoromethoxy)phenyl]acetamide
| Molecular Formula | C17H12BrF2N3O3S |
|---|---|
| Molecular Weight | 454.98 g/mol |
| LogP | 4.8313 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.97507 |
| Heavy Atoms | 27 |
| Complexity | 904.54694 |
Chemical Identifiers
| CAS Number | 5392-49-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=C(O2)SCC(=O)NC3=CC=C(C=C3)OC(F)F)Br |
Product Overview
2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide (CAS 5392-49-4), with molecular formula C17H12BrF2N3O3S and molecular weight 454.98 g/mol. IUPAC: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide.
Chemical Property Profile of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
Property Insights of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
The XLogP value of 4.8313 indicates that 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide. Following Lipinski's Rule of Five, 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide has 1 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 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide?
The CAS number of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide is 5392-49-4.
What is the molecular formula of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide?
The molecular formula of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide is C17H12BrF2N3O3S.
What is the molecular weight of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide?
The molecular weight of 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide is 454.98 g/mol.
Where can I buy 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide?
You can request a quote for 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.