3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one
TL;DR: 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one (CAS 42580-60-9) is a chemical compound with molecular formula C22H16O3 and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one
Also Known As: 3,4-METHYLENEDIOXY-4'-PHENYLCHALCONE, 3-(1,3-benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one, 3-benzo[1,3]dioxol-5-yl-1-(4-phenylphenyl)prop-2-en-1-one, (2E)-3-(2H-1,3-benzodioxol-5-yl)-1-{[1,1'-biphenyl]-4-yl}prop-2-en-1-one
| Molecular Formula | C22H16O3 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 4.9784 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.10995 |
| Heavy Atoms | 25 |
| Complexity | 925.246 |
Chemical Identifiers
| CAS Number | 42580-60-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4 |
Product Overview
3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one (CAS 42580-60-9), with molecular formula C22H16O3 and molecular weight 328.11 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one.
Chemical Property Profile of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one
Property Insights of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one
The XLogP value of 4.9784 indicates that 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one 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 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one?
The CAS number of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one is 42580-60-9.
What is the molecular formula of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one?
The molecular formula of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one is C22H16O3.
What is the molecular weight of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one?
The molecular weight of 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one is 328.11 g/mol.
Where can I buy 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one?
You can request a quote for 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-Benzodioxol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.