2'-Aminochalcone
TL;DR: 2'-Aminochalcone (CAS 78396-00-6) 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.
1-(2-aminophenyl)-3-phenylprop-2-en-1-one
Also Known As: 2'-aminochalcone, 1-(2-aminophenyl)-3-phenylprop-2-en-1-one, 2-Propen-1-one, 1-(2-aminophenyl)-3-phenyl-, 2-Propen-1-one, 1-(2-aminophenyl)-3-phenyl-, (2E)-
| Molecular Formula | C15H13NO |
|---|---|
| Molecular Weight | 223.10 g/mol |
| LogP | 3.6 |
| 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 | 279.0 |
Chemical Identifiers
| CAS Number | 78396-00-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2N |
| InChIKey | XKXLBHSNDSFICW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2'-Aminochalcone (CAS 78396-00-6), with molecular formula C15H13NO and molecular weight 223.10 g/mol. IUPAC: 1-(2-aminophenyl)-3-phenylprop-2-en-1-one.
Chemical Property Profile of 2'-Aminochalcone
Property Insights of 2'-Aminochalcone
The XLogP value of 3.6 indicates that 2'-Aminochalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 2'-Aminochalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-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 2'-Aminochalcone?
The CAS number of 2'-Aminochalcone is 78396-00-6.
What is the molecular formula of 2'-Aminochalcone?
The molecular formula of 2'-Aminochalcone is C15H13NO.
What is the molecular weight of 2'-Aminochalcone?
The molecular weight of 2'-Aminochalcone is 223.10 g/mol.
Where can I buy 2'-Aminochalcone?
You can request a quote for 2'-Aminochalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Aminochalcone?
Yes, KEHONG BIO provides custom synthesis services for 2'-Aminochalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.