AQ-088/41086590
TL;DR: AQ-088/41086590 (CAS 500265-62-3) is a chemical compound with molecular formula C23H24FN5O3S and molecular weight 469.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-N-[3-[4-methyl-5-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide
Also Known As: AQ-088/41086590, 2-fluoro-N-[3-[4-methyl-5-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide, 2-fluoro-N-(3-(4-methyl-5-((2-oxo-2-(((tetrahydrofuran-2-yl)methyl)amino)ethyl)thio)-4H-1,2,4-triazol-3-yl)phenyl)benzamide, 2-fluoro-N-{3-[4-methyl-5-({2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide, 2-fluoro-N-{3-[4-methyl-5-({2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}thio)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
| Molecular Formula | C23H24FN5O3S |
|---|---|
| Molecular Weight | 469.16 g/mol |
| LogP | 3.2608 |
| Topological Polar Surface Area | 98.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.1584 |
| Heavy Atoms | 33 |
| Complexity | 1146.6305 |
Chemical Identifiers
| CAS Number | 500265-62-3 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NCC2CCCO2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4F |
Product Overview
AQ-088/41086590 (CAS 500265-62-3), with molecular formula C23H24FN5O3S and molecular weight 469.16 g/mol. IUPAC: 2-fluoro-N-[3-[4-methyl-5-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide.
Chemical Property Profile of AQ-088/41086590
Property Insights of AQ-088/41086590
The XLogP value of 3.2608 indicates that AQ-088/41086590 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-088/41086590. Following Lipinski's Rule of Five, AQ-088/41086590 has 2 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 AQ-088/41086590?
The CAS number of AQ-088/41086590 is 500265-62-3.
What is the molecular formula of AQ-088/41086590?
The molecular formula of AQ-088/41086590 is C23H24FN5O3S.
What is the molecular weight of AQ-088/41086590?
The molecular weight of AQ-088/41086590 is 469.16 g/mol.
Where can I buy AQ-088/41086590?
You can request a quote for AQ-088/41086590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-088/41086590?
Yes, KEHONG BIO provides custom synthesis services for AQ-088/41086590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.