3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one
TL;DR: 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one (CAS 358656-11-8) is a chemical compound with molecular formula C22H17BrO2 and molecular weight 392.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromophenyl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one
Also Known As: (2E)-3-[4-(Benzyloxy)phenyl]-1-(3-bromophenyl)prop-2-en-1-one, 3-(4-benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one, 1-(3-bromophenyl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one
| Molecular Formula | C22H17BrO2 |
|---|---|
| Molecular Weight | 392.04 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.0412 |
| Heavy Atoms | 25 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 358656-11-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C=CC(=O)C3=CC(=CC=C3)Br |
| InChIKey | XHCZBACAIYODFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one (CAS 358656-11-8), with molecular formula C22H17BrO2 and molecular weight 392.04 g/mol. IUPAC: 1-(3-bromophenyl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one
Property Insights of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one
The XLogP value of 5.8 indicates that 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)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 26.3 Ų, 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one?
The CAS number of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one is 358656-11-8.
What is the molecular formula of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one?
The molecular formula of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one is C22H17BrO2.
What is the molecular weight of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one?
The molecular weight of 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one is 392.04 g/mol.
Where can I buy 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one?
You can request a quote for 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)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-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Benzyloxyphenyl)-1-(3-bromophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.