AB00005964-01
TL;DR: AB00005964-01 (CAS 1025226-71-4) is a chemical compound with molecular formula C24H22N2O3 and molecular weight 386.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-(1H-indol-3-yl)prop-2-en-1-one
Also Known As: AB00005964-01, 1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-(1H-indol-3-yl)prop-2-en-1-one
| Molecular Formula | C24H22N2O3 |
|---|---|
| Molecular Weight | 386.16 g/mol |
| LogP | 3.4688 |
| Topological Polar Surface Area | 54.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.16306 |
| Heavy Atoms | 29 |
| Complexity | 1076.9193 |
Chemical Identifiers
| CAS Number | 1025226-71-4 |
|---|---|
| SMILES | C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)/C=C/C3=CNC4=CC=CC=C43 |
Product Overview
AB00005964-01 (CAS 1025226-71-4), with molecular formula C24H22N2O3 and molecular weight 386.16 g/mol. IUPAC: (E)-1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-3-(1H-indol-3-yl)prop-2-en-1-one.
Chemical Property Profile of AB00005964-01
Property Insights of AB00005964-01
The XLogP value of 3.4688 indicates that AB00005964-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.56 Ų, AB00005964-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00005964-01 has 1 hydrogen bond donor(s) and 3 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 AB00005964-01?
The CAS number of AB00005964-01 is 1025226-71-4.
What is the molecular formula of AB00005964-01?
The molecular formula of AB00005964-01 is C24H22N2O3.
What is the molecular weight of AB00005964-01?
The molecular weight of AB00005964-01 is 386.16 g/mol.
Where can I buy AB00005964-01?
You can request a quote for AB00005964-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00005964-01?
Yes, KEHONG BIO provides custom synthesis services for AB00005964-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.