2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-
TL;DR: 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- (CAS 126443-18-3) is a chemical compound with molecular formula C16H13BrO2 and molecular weight 316.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
Also Known As: 4-bromo-4'-methoxychalcone, 4-bromo-4'-methoxyl-chalcone, 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-, 3-(4-bromophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one, (2E)-3-(4-bromophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
| Molecular Formula | C16H13BrO2 |
|---|---|
| Molecular Weight | 316.01 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.0099 |
| Heavy Atoms | 19 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 126443-18-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Br |
| InChIKey | DDKSEIMPHBCIKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- (CAS 126443-18-3), with molecular formula C16H13BrO2 and molecular weight 316.01 g/mol. IUPAC: 3-(4-bromophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-
Property Insights of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-
The XLogP value of 3.7 indicates that 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- has 0 hydrogen bond donor(s) and 2 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 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-?
The CAS number of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- is 126443-18-3.
What is the molecular formula of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-?
The molecular formula of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- is C16H13BrO2.
What is the molecular weight of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-?
The molecular weight of 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- is 316.01 g/mol.
Where can I buy 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-?
You can request a quote for 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propen-1-one, 3-(4-bromophenyl)-1-(4-methoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.