4-(N,N-dimethylamino)-2'-hydroxychalcone
TL;DR: 4-(N,N-dimethylamino)-2'-hydroxychalcone (CAS 65786-13-2) is a chemical compound with molecular formula C17H17NO2 and molecular weight 267.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(dimethylamino)phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one
Also Known As: 4-(dimethylamino)-2'-hydroxychalcone, 2'-Hydroxy-4-(dimethylamino)chalcone, 4-(N,N-dimethylamino)-2'-hydroxychalcone, 3-[4-(dimethylamino)phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one, (2E)-3-[4-(dimethylamino)phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one
| Molecular Formula | C17H17NO2 |
|---|---|
| Molecular Weight | 267.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.12592 |
| Heavy Atoms | 20 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 65786-13-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2O |
| InChIKey | NSBRMLGDDBWATL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(N,N-dimethylamino)-2'-hydroxychalcone (CAS 65786-13-2), with molecular formula C17H17NO2 and molecular weight 267.13 g/mol. IUPAC: 3-[4-(dimethylamino)phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 4-(N,N-dimethylamino)-2'-hydroxychalcone
Property Insights of 4-(N,N-dimethylamino)-2'-hydroxychalcone
The XLogP value of 4.0 indicates that 4-(N,N-dimethylamino)-2'-hydroxychalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 4-(N,N-dimethylamino)-2'-hydroxychalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(N,N-dimethylamino)-2'-hydroxychalcone has 1 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-(N,N-dimethylamino)-2'-hydroxychalcone?
The CAS number of 4-(N,N-dimethylamino)-2'-hydroxychalcone is 65786-13-2.
What is the molecular formula of 4-(N,N-dimethylamino)-2'-hydroxychalcone?
The molecular formula of 4-(N,N-dimethylamino)-2'-hydroxychalcone is C17H17NO2.
What is the molecular weight of 4-(N,N-dimethylamino)-2'-hydroxychalcone?
The molecular weight of 4-(N,N-dimethylamino)-2'-hydroxychalcone is 267.13 g/mol.
Where can I buy 4-(N,N-dimethylamino)-2'-hydroxychalcone?
You can request a quote for 4-(N,N-dimethylamino)-2'-hydroxychalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(N,N-dimethylamino)-2'-hydroxychalcone?
Yes, KEHONG BIO provides custom synthesis services for 4-(N,N-dimethylamino)-2'-hydroxychalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.