AQ-088/41086762
TL;DR: AQ-088/41086762 (CAS 500265-67-8) is a chemical compound with molecular formula C23H27N5O2S and molecular weight 437.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-acetamidophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide
Also Known As: AQ-088/41086762, 2-({5-[3-(acetylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-diethylphenyl)acetamide, 2-[[5-(3-acetamidophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide, 2-((5-(3-acetamidophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(2,6-diethylphenyl)acetamide, N-[3-[5-[(2,6-diethylphenyl)carbamoylmethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]acetamide
| Molecular Formula | C23H27N5O2S |
|---|---|
| Molecular Weight | 437.19 g/mol |
| LogP | 4.2961 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.18854 |
| Heavy Atoms | 31 |
| Complexity | 1071.0709 |
Chemical Identifiers
| CAS Number | 500265-67-8 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NN=C(N2C)C3=CC(=CC=C3)NC(=O)C |
Product Overview
AQ-088/41086762 (CAS 500265-67-8), with molecular formula C23H27N5O2S and molecular weight 437.19 g/mol. IUPAC: 2-[[5-(3-acetamidophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide.
Chemical Property Profile of AQ-088/41086762
Property Insights of AQ-088/41086762
The XLogP value of 4.2961 indicates that AQ-088/41086762 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-088/41086762. Following Lipinski's Rule of Five, AQ-088/41086762 has 2 hydrogen bond donor(s) and 5 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-088/41086762?
The CAS number of AQ-088/41086762 is 500265-67-8.
What is the molecular formula of AQ-088/41086762?
The molecular formula of AQ-088/41086762 is C23H27N5O2S.
What is the molecular weight of AQ-088/41086762?
The molecular weight of AQ-088/41086762 is 437.19 g/mol.
Where can I buy AQ-088/41086762?
You can request a quote for AQ-088/41086762 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-088/41086762?
Yes, KEHONG BIO provides custom synthesis services for AQ-088/41086762 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.