BAS 13322081
TL;DR: BAS 13322081 (CAS 879765-03-4) is a chemical compound with molecular formula C17H16BrN3O5 and molecular weight 421.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylfuran-2-carboxamide
Also Known As: BAS 13322081, 5-bromo-N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-N-methylfuran-2-carboxamide, 5-bromo-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylfuran-2-carboxamide, 5-bromo-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methylfuran-2-carboxamide
| Molecular Formula | C17H16BrN3O5 |
|---|---|
| Molecular Weight | 421.03 g/mol |
| LogP | 3.3815 |
| Topological Polar Surface Area | 90.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.02734 |
| Heavy Atoms | 26 |
| Complexity | 920.77155 |
Chemical Identifiers
| CAS Number | 879765-03-4 |
|---|---|
| SMILES | CN(CC1=NC(=NO1)C2=CC(=C(C=C2)OC)OC)C(=O)C3=CC=C(O3)Br |
Product Overview
BAS 13322081 (CAS 879765-03-4), with molecular formula C17H16BrN3O5 and molecular weight 421.03 g/mol. IUPAC: 5-bromo-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylfuran-2-carboxamide.
Chemical Property Profile of BAS 13322081
Property Insights of BAS 13322081
The XLogP value of 3.3815 indicates that BAS 13322081 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13322081. Following Lipinski's Rule of Five, BAS 13322081 has 0 hydrogen bond donor(s) and 7 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 BAS 13322081?
The CAS number of BAS 13322081 is 879765-03-4.
What is the molecular formula of BAS 13322081?
The molecular formula of BAS 13322081 is C17H16BrN3O5.
What is the molecular weight of BAS 13322081?
The molecular weight of BAS 13322081 is 421.03 g/mol.
Where can I buy BAS 13322081?
You can request a quote for BAS 13322081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13322081?
Yes, KEHONG BIO provides custom synthesis services for BAS 13322081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.