4-Chloro-4'-methylchalcone
TL;DR: 4-Chloro-4'-methylchalcone (CAS 37620-37-4) is a chemical compound with molecular formula C16H13ClO and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-1-(4-methylphenyl)prop-2-en-1-one
Also Known As: 4-chloro-4'-methylchalcone, 3-(4-chlorophenyl)-1-(4-methylphenyl)prop-2-en-1-one, BUTTPARK 107\40-99, 3-(4-Chlorophenyl)-1-(p-tolyl)prop-2-en-1-one, 1-(4-chlorophenyl)-3-p-tolylprop-2-en-1-one
| Molecular Formula | C16H13ClO |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.0655 |
| Heavy Atoms | 18 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 37620-37-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl |
| InChIKey | WSEZVGWJTWBTQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-4'-methylchalcone (CAS 37620-37-4), with molecular formula C16H13ClO and molecular weight 256.07 g/mol. IUPAC: 3-(4-chlorophenyl)-1-(4-methylphenyl)prop-2-en-1-one.
Chemical Property Profile of 4-Chloro-4'-methylchalcone
Property Insights of 4-Chloro-4'-methylchalcone
The XLogP value of 4.1 indicates that 4-Chloro-4'-methylchalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Chloro-4'-methylchalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-4'-methylchalcone has 0 hydrogen bond donor(s) and 1 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-Chloro-4'-methylchalcone?
The CAS number of 4-Chloro-4'-methylchalcone is 37620-37-4.
What is the molecular formula of 4-Chloro-4'-methylchalcone?
The molecular formula of 4-Chloro-4'-methylchalcone is C16H13ClO.
What is the molecular weight of 4-Chloro-4'-methylchalcone?
The molecular weight of 4-Chloro-4'-methylchalcone is 256.07 g/mol.
Where can I buy 4-Chloro-4'-methylchalcone?
You can request a quote for 4-Chloro-4'-methylchalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-4'-methylchalcone?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-4'-methylchalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.