AO-081/15570026
TL;DR: AO-081/15570026 (CAS 444712-75-8) is a chemical compound with molecular formula C19H19IN4O2 and molecular weight 462.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2E)-2-[(3-iodo-4-prop-2-enoxyphenyl)methylidene]hydrazinyl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Also Known As: AO-081/15570026, 2-(2-(4-(Allyloxy)-3-iodobenzylidene)hydrazineyl)-4-(methoxymethyl)-6-methylnicotinonitrile, 2-{(2E)-2-[3-iodo-4-(prop-2-en-1-yloxy)benzylidene]hydrazinyl}-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
| Molecular Formula | C19H19IN4O2 |
|---|---|
| Molecular Weight | 462.06 g/mol |
| LogP | 4.0235 |
| Topological Polar Surface Area | 79.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 462.05527 |
| Heavy Atoms | 26 |
| Complexity | 859.34814 |
Chemical Identifiers
| CAS Number | 444712-75-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)N/N=C/C2=CC(=C(C=C2)OCC=C)I)C#N)COC |
Product Overview
AO-081/15570026 (CAS 444712-75-8), with molecular formula C19H19IN4O2 and molecular weight 462.06 g/mol. IUPAC: 2-[(2E)-2-[(3-iodo-4-prop-2-enoxyphenyl)methylidene]hydrazinyl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of AO-081/15570026
Property Insights of AO-081/15570026
The XLogP value of 4.0235 indicates that AO-081/15570026 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.53 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15570026. Following Lipinski's Rule of Five, AO-081/15570026 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-081/15570026?
The CAS number of AO-081/15570026 is 444712-75-8.
What is the molecular formula of AO-081/15570026?
The molecular formula of AO-081/15570026 is C19H19IN4O2.
What is the molecular weight of AO-081/15570026?
The molecular weight of AO-081/15570026 is 462.06 g/mol.
Where can I buy AO-081/15570026?
You can request a quote for AO-081/15570026 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15570026?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15570026 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.