1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone
TL;DR: 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone (CAS 164171-94-2) is a chemical compound with molecular formula C19H20BrNO and molecular weight 357.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-one
Also Known As: 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone, (E)-1-(4-BROMO-PHENYL)-3-(4-DIETHYLAMINO-PHENYL)-PROPENONE, 1-(4-bromophenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-one
| Molecular Formula | C19H20BrNO |
|---|---|
| Molecular Weight | 357.07 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.0728 |
| Heavy Atoms | 22 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 164171-94-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Br |
| InChIKey | BYLKWMPIZGRAOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone (CAS 164171-94-2), with molecular formula C19H20BrNO and molecular weight 357.07 g/mol. IUPAC: 1-(4-bromophenyl)-3-[4-(diethylamino)phenyl]prop-2-en-1-one.
Chemical Property Profile of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone
Property Insights of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone
The XLogP value of 5.2 indicates that 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone 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 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone?
The CAS number of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone is 164171-94-2.
What is the molecular formula of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone?
The molecular formula of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone is C19H20BrNO.
What is the molecular weight of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone?
The molecular weight of 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone is 357.07 g/mol.
Where can I buy 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone?
You can request a quote for 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromo-phenyl)-3-(4-diethylamino-phenyl)-propenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.