AE-641/41201900
TL;DR: AE-641/41201900 (CAS 326882-35-3) is a chemical compound with molecular formula C23H16Cl3N3O2S and molecular weight 503.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: AE-641/41201900, 1-(4-chlorophenyl)-2-({5-[(2,4-dichlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone, 1-(4-chlorophenyl)-2-((5-((2,4-dichlorophenoxy)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)ethanone, 1-(4-chlorophenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone, 2-{5-[(2,4-dichlorophenoxy)methyl]-4-phenyl(1,2,4-triazol-3-ylthio)}-1-(4-chlo rophenyl)ethan-1-one
| Molecular Formula | C23H16Cl3N3O2S |
|---|---|
| Molecular Weight | 503.00 g/mol |
| LogP | 6.7815 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 503.00287 |
| Heavy Atoms | 32 |
| Complexity | 1231.2325 |
Chemical Identifiers
| CAS Number | 326882-35-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)Cl)COC4=C(C=C(C=C4)Cl)Cl |
Product Overview
AE-641/41201900 (CAS 326882-35-3), with molecular formula C23H16Cl3N3O2S and molecular weight 503.00 g/mol. IUPAC: 1-(4-chlorophenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of AE-641/41201900
Property Insights of AE-641/41201900
The XLogP value of 6.7815 indicates that AE-641/41201900 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, AE-641/41201900 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-641/41201900 has 0 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 AE-641/41201900?
The CAS number of AE-641/41201900 is 326882-35-3.
What is the molecular formula of AE-641/41201900?
The molecular formula of AE-641/41201900 is C23H16Cl3N3O2S.
What is the molecular weight of AE-641/41201900?
The molecular weight of AE-641/41201900 is 503.00 g/mol.
Where can I buy AE-641/41201900?
You can request a quote for AE-641/41201900 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/41201900?
Yes, KEHONG BIO provides custom synthesis services for AE-641/41201900 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.