4,4a(2)-Dimethoxychalcone
TL;DR: 4,4a(2)-Dimethoxychalcone (CAS 2373-89-9) is a chemical compound with molecular formula C17H16O3 and molecular weight 268.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(4-methoxyphenyl)prop-2-en-1-one
Also Known As: 4,4'-Dimethoxychalcone, 4,4a(2)-Dimethoxychalcone, NCIOpen2_005208, 1,3-bis(4-methoxyphenyl)prop-2-en-1-one, (E)-4,4'-Dimethoxychalcone
| Molecular Formula | C17H16O3 |
|---|---|
| Molecular Weight | 268.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.10995 |
| Heavy Atoms | 20 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 2373-89-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OC |
| InChIKey | HDXVSZWKIHQDES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4a(2)-Dimethoxychalcone (CAS 2373-89-9), with molecular formula C17H16O3 and molecular weight 268.11 g/mol. IUPAC: 1,3-bis(4-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 4,4a(2)-Dimethoxychalcone
Property Insights of 4,4a(2)-Dimethoxychalcone
The XLogP value of 3.0 indicates that 4,4a(2)-Dimethoxychalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 4,4a(2)-Dimethoxychalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4a(2)-Dimethoxychalcone has 0 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 4,4a(2)-Dimethoxychalcone?
The CAS number of 4,4a(2)-Dimethoxychalcone is 2373-89-9.
What is the molecular formula of 4,4a(2)-Dimethoxychalcone?
The molecular formula of 4,4a(2)-Dimethoxychalcone is C17H16O3.
What is the molecular weight of 4,4a(2)-Dimethoxychalcone?
The molecular weight of 4,4a(2)-Dimethoxychalcone is 268.11 g/mol.
Where can I buy 4,4a(2)-Dimethoxychalcone?
You can request a quote for 4,4a(2)-Dimethoxychalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4a(2)-Dimethoxychalcone?
Yes, KEHONG BIO provides custom synthesis services for 4,4a(2)-Dimethoxychalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.