AN-023/41116846
TL;DR: AN-023/41116846 (CAS 445459-95-0) is a chemical compound with molecular formula C26H24N2O3 and molecular weight 412.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[[3-methoxy-4-(2-phenylethoxy)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one
Also Known As: AN-023/41116846, (4Z)-4-[[3-methoxy-4-(2-phenylethoxy)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one, 4-[3-methoxy-4-(2-phenylethoxy)benzylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4Z)-4-[(3-methoxy-4-phenethyloxyphenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one
| Molecular Formula | C26H24N2O3 |
|---|---|
| Molecular Weight | 412.18 g/mol |
| LogP | 5.1228 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 412.17868 |
| Heavy Atoms | 31 |
| Complexity | 1121.9037 |
Chemical Identifiers
| CAS Number | 445459-95-0 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C\C2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC)C4=CC=CC=C4 |
Product Overview
AN-023/41116846 (CAS 445459-95-0), with molecular formula C26H24N2O3 and molecular weight 412.18 g/mol. IUPAC: (4Z)-4-[[3-methoxy-4-(2-phenylethoxy)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one.
Chemical Property Profile of AN-023/41116846
Property Insights of AN-023/41116846
The XLogP value of 5.1228 indicates that AN-023/41116846 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, AN-023/41116846 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-023/41116846 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-023/41116846?
The CAS number of AN-023/41116846 is 445459-95-0.
What is the molecular formula of AN-023/41116846?
The molecular formula of AN-023/41116846 is C26H24N2O3.
What is the molecular weight of AN-023/41116846?
The molecular weight of AN-023/41116846 is 412.18 g/mol.
Where can I buy AN-023/41116846?
You can request a quote for AN-023/41116846 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-023/41116846?
Yes, KEHONG BIO provides custom synthesis services for AN-023/41116846 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.