4-Aminochalcone
TL;DR: 4-Aminochalcone (CAS 956-05-8) is a chemical compound with molecular formula C15H13NO and molecular weight 223.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-aminophenyl)-1-phenylprop-2-en-1-one
Also Known As: 4-aminochalcone, 2-Propen-1-one, 3- (4-aminophenyl)-1-phenyl-, 3-(4-aminophenyl)-1-phenylprop-2-en-1-one, 2-Propen-1-one, 3-(4-aminophenyl)-1-phenyl-
| Molecular Formula | C15H13NO |
|---|---|
| Molecular Weight | 223.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.09972 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 956-05-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)N |
| InChIKey | ODCATTUUPYWMMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Aminochalcone (CAS 956-05-8), with molecular formula C15H13NO and molecular weight 223.10 g/mol. IUPAC: 3-(4-aminophenyl)-1-phenylprop-2-en-1-one.
Chemical Property Profile of 4-Aminochalcone
Property Insights of 4-Aminochalcone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminochalcone. With a topological polar surface area (TPSA) of 43.1 Ų, 4-Aminochalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Aminochalcone has 1 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 4-Aminochalcone?
The CAS number of 4-Aminochalcone is 956-05-8.
What is the molecular formula of 4-Aminochalcone?
The molecular formula of 4-Aminochalcone is C15H13NO.
What is the molecular weight of 4-Aminochalcone?
The molecular weight of 4-Aminochalcone is 223.10 g/mol.
Where can I buy 4-Aminochalcone?
You can request a quote for 4-Aminochalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Aminochalcone?
Yes, KEHONG BIO provides custom synthesis services for 4-Aminochalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.