AO-080/42479555
TL;DR: AO-080/42479555 (CAS 632298-85-2) is a chemical compound with molecular formula C26H34N2O3S and molecular weight 454.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[2-(4-cyclohexylphenoxy)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide
Also Known As: AO-080/42479555, N-[1-[2-(4-cyclohexylphenoxy)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide, N-[1-({[2-(4-cyclohexylphenoxy)ethyl]amino}carbonyl)-3-(methylsulfanyl)propyl]benzamide
| Molecular Formula | C26H34N2O3S |
|---|---|
| Molecular Weight | 454.23 g/mol |
| LogP | 4.781 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 454.229 |
| Heavy Atoms | 32 |
| Complexity | 835.91034 |
Chemical Identifiers
| CAS Number | 632298-85-2 |
|---|---|
| SMILES | CSCCC(C(=O)NCCOC1=CC=C(C=C1)C2CCCCC2)NC(=O)C3=CC=CC=C3 |
Product Overview
AO-080/42479555 (CAS 632298-85-2), with molecular formula C26H34N2O3S and molecular weight 454.23 g/mol. IUPAC: N-[1-[2-(4-cyclohexylphenoxy)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide.
Chemical Property Profile of AO-080/42479555
Property Insights of AO-080/42479555
The XLogP value of 4.781 indicates that AO-080/42479555 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-080/42479555. Following Lipinski's Rule of Five, AO-080/42479555 has 2 hydrogen bond donor(s) and 4 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-080/42479555?
The CAS number of AO-080/42479555 is 632298-85-2.
What is the molecular formula of AO-080/42479555?
The molecular formula of AO-080/42479555 is C26H34N2O3S.
What is the molecular weight of AO-080/42479555?
The molecular weight of AO-080/42479555 is 454.23 g/mol.
Where can I buy AO-080/42479555?
You can request a quote for AO-080/42479555 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-080/42479555?
Yes, KEHONG BIO provides custom synthesis services for AO-080/42479555 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.