AQ-088/41086127
TL;DR: AQ-088/41086127 (CAS 500265-51-0) is a chemical compound with molecular formula C24H23N5OS and molecular weight 429.16232 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-benzhydrylacetamide
Also Known As: AQ-088/41086127, 2-{[5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(diphenylmethyl)acetamide, 2-((5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-benzhydrylacetamide, 2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-benzhydrylacetamide, 2-{[5-(3-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-benzhydrylacetamide
Technical Specifications
| Molecular Formula | C24H23N5OS |
| Molecular Weight | 429.16232 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.16232 Da |
| Heavy Atoms | 31 |
| Complexity | 548.0 |
| SMILES | CN1C(=NN=C1SCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC(=CC=C4)N |
| InChIKey | XQYPKZOEIIQCGC-UHFFFAOYSA-N |
Chemical Property Profile of AQ-088/41086127
Property Insights of AQ-088/41086127
The XLogP value of 3.8 indicates that AQ-088/41086127 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-088/41086127. Following Lipinski's Rule of Five, AQ-088/41086127 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
What is the CAS number of AQ-088/41086127?
The CAS number of AQ-088/41086127 is 500265-51-0.
What is the molecular formula of AQ-088/41086127?
The molecular formula of AQ-088/41086127 is C24H23N5OS.
What is the molecular weight of AQ-088/41086127?
The molecular weight of AQ-088/41086127 is 429.16232 g/mol.
Where can I buy AQ-088/41086127?
You can request a quote for AQ-088/41086127 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AQ-088/41086127?
Yes, CoreyChem provides custom synthesis services for AQ-088/41086127 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.