AQ-088/41086125
TL;DR: AQ-088/41086125 (CAS 526192-67-6) is a chemical compound with molecular formula C19H21N5O3S and molecular weight 399.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide
Also Known As: AQ-088/41086125, 2-{[5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide, 2-((5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(2,5-dimethoxyphenyl)acetamide, 2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide
| Molecular Formula | C19H21N5O3S |
|---|---|
| Molecular Weight | 399.14 g/mol |
| LogP | 2.8123 |
| Topological Polar Surface Area | 104.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.1365 |
| Heavy Atoms | 28 |
| Complexity | 989.4505 |
Chemical Identifiers
| CAS Number | 526192-67-6 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)OC)OC)C3=CC(=CC=C3)N |
Product Overview
AQ-088/41086125 (CAS 526192-67-6), with molecular formula C19H21N5O3S and molecular weight 399.14 g/mol. IUPAC: 2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide.
Chemical Property Profile of AQ-088/41086125
Property Insights of AQ-088/41086125
The XLogP value of 2.8123 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AQ-088/41086125. The TPSA of 104.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-088/41086125. Following Lipinski's Rule of Five, AQ-088/41086125 has 2 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 AQ-088/41086125?
The CAS number of AQ-088/41086125 is 526192-67-6.
What is the molecular formula of AQ-088/41086125?
The molecular formula of AQ-088/41086125 is C19H21N5O3S.
What is the molecular weight of AQ-088/41086125?
The molecular weight of AQ-088/41086125 is 399.14 g/mol.
Where can I buy AQ-088/41086125?
You can request a quote for AQ-088/41086125 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-088/41086125?
Yes, KEHONG BIO provides custom synthesis services for AQ-088/41086125 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.