AP-970/42897300
TL;DR: AP-970/42897300 (CAS 823823-84-3) is a chemical compound with molecular formula C20H18BrN5O2S and molecular weight 471.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-ethoxy-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Also Known As: AP-970/42897300, 3-bromo-4-ethoxy-N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide, 3-bromo-4-ethoxy-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
| Molecular Formula | C20H18BrN5O2S |
|---|---|
| Molecular Weight | 471.04 g/mol |
| LogP | 4.8287 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 471.03647 |
| Heavy Atoms | 29 |
| Complexity | 1169.5548 |
Chemical Identifiers
| CAS Number | 823823-84-3 |
|---|---|
| SMILES | CCC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)OCC)Br |
Product Overview
AP-970/42897300 (CAS 823823-84-3), with molecular formula C20H18BrN5O2S and molecular weight 471.04 g/mol. IUPAC: 3-bromo-4-ethoxy-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide.
Chemical Property Profile of AP-970/42897300
Property Insights of AP-970/42897300
The XLogP value of 4.8287 indicates that AP-970/42897300 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.41 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42897300. Following Lipinski's Rule of Five, AP-970/42897300 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 AP-970/42897300?
The CAS number of AP-970/42897300 is 823823-84-3.
What is the molecular formula of AP-970/42897300?
The molecular formula of AP-970/42897300 is C20H18BrN5O2S.
What is the molecular weight of AP-970/42897300?
The molecular weight of AP-970/42897300 is 471.04 g/mol.
Where can I buy AP-970/42897300?
You can request a quote for AP-970/42897300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42897300?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42897300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.