AO-081/40681515
TL;DR: AO-081/40681515 (CAS 355428-01-2) is a chemical compound with molecular formula C20H24N2O5S and molecular weight 404.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenoxy]acetate
Also Known As: AO-081/40681515, (E)-tert-butyl 2-(4-((2-tosylhydrazono)methyl)phenoxy)acetate, tert-butyl {4-[(E)-{2-[(4-methylphenyl)sulfonyl]hydrazinylidene}methyl]phenoxy}acetate, tert-butyl 2-[4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenoxy]acetate, tert-butyl (4-{2-[(4-methylphenyl)sulfonyl]carbohydrazonoyl}phenoxy)acetate
| Molecular Formula | C20H24N2O5S |
|---|---|
| Molecular Weight | 404.14 g/mol |
| LogP | 3.02792 |
| Topological Polar Surface Area | 94.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.1406 |
| Heavy Atoms | 28 |
| Complexity | 928.0565 |
Chemical Identifiers
| CAS Number | 355428-01-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC=C(C=C2)OCC(=O)OC(C)(C)C |
Product Overview
AO-081/40681515 (CAS 355428-01-2), with molecular formula C20H24N2O5S and molecular weight 404.14 g/mol. IUPAC: tert-butyl 2-[4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]phenoxy]acetate.
Chemical Property Profile of AO-081/40681515
Property Insights of AO-081/40681515
The XLogP value of 3.02792 indicates that AO-081/40681515 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.06 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/40681515. Following Lipinski's Rule of Five, AO-081/40681515 has 1 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 AO-081/40681515?
The CAS number of AO-081/40681515 is 355428-01-2.
What is the molecular formula of AO-081/40681515?
The molecular formula of AO-081/40681515 is C20H24N2O5S.
What is the molecular weight of AO-081/40681515?
The molecular weight of AO-081/40681515 is 404.14 g/mol.
Where can I buy AO-081/40681515?
You can request a quote for AO-081/40681515 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/40681515?
Yes, KEHONG BIO provides custom synthesis services for AO-081/40681515 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.