AQ-088/41137319
TL;DR: AQ-088/41137319 (CAS 511308-13-7) is a chemical compound with molecular formula C26H25N5O2S and molecular weight 471.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[5-(2-anilino-2-oxoethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]phenyl]-2-methylbenzamide
Also Known As: AQ-088/41137319, N-[4-[5-(2-anilino-2-oxoethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]phenyl]-2-methylbenzamide, N-[4-(4-ethyl-5-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]-2-methylbenzamide, N-(4-{5-[(2-anilino-2-oxoethyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}phenyl)-2-methylbenzamide, N-[4-(4-ETHYL-5-{[(PHENYLCARBAMOYL)METHYL]SULFANYL}-1,2,4-TRIAZOL-3-YL)PHENYL]-2-METHYLBENZAMIDE
| Molecular Formula | C26H25N5O2S |
|---|---|
| Molecular Weight | 471.17 g/mol |
| LogP | 5.25652 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 471.17288 |
| Heavy Atoms | 34 |
| Complexity | 1286.311 |
Chemical Identifiers
| CAS Number | 511308-13-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C |
Product Overview
AQ-088/41137319 (CAS 511308-13-7), with molecular formula C26H25N5O2S and molecular weight 471.17 g/mol. IUPAC: N-[4-[5-(2-anilino-2-oxoethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]phenyl]-2-methylbenzamide.
Chemical Property Profile of AQ-088/41137319
Property Insights of AQ-088/41137319
The XLogP value of 5.25652 indicates that AQ-088/41137319 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-088/41137319. Following Lipinski's Rule of Five, AQ-088/41137319 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AQ-088/41137319?
The CAS number of AQ-088/41137319 is 511308-13-7.
What is the molecular formula of AQ-088/41137319?
The molecular formula of AQ-088/41137319 is C26H25N5O2S.
What is the molecular weight of AQ-088/41137319?
The molecular weight of AQ-088/41137319 is 471.17 g/mol.
Where can I buy AQ-088/41137319?
You can request a quote for AQ-088/41137319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-088/41137319?
Yes, KEHONG BIO provides custom synthesis services for AQ-088/41137319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.