Tunicatachalcone
TL;DR: Tunicatachalcone (CAS 329038-96-2) is a chemical compound with molecular formula C26H30O4 and molecular weight 406.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-1-hydroxy-3-phenylprop-2-enylidene]-5-methoxy-2,2-bis(3-methylbut-2-enyl)cyclohex-4-ene-1,3-dione
Also Known As: Tunicatachalcone, 4-Cinnamoyl-5-hydroxy-3-methoxy-6,6-bis(3-methylbut-2-en-1-yl)cyclohexa-2,4-dien-1-one
| Molecular Formula | C26H30O4 |
|---|---|
| Molecular Weight | 406.21 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.21442 |
| Heavy Atoms | 30 |
| Complexity | 786.0 |
Chemical Identifiers
| CAS Number | 329038-96-2 |
|---|---|
| SMILES | CC(=CCC1(C(=O)C=C(C(=C(/C=C/C2=CC=CC=C2)O)C1=O)OC)CC=C(C)C)C |
| InChIKey | FHECBCWIVGBBEG-PSLRBCBWSA-N |
Product Overview
Tunicatachalcone (CAS 329038-96-2), with molecular formula C26H30O4 and molecular weight 406.21 g/mol. IUPAC: 6-[(E)-1-hydroxy-3-phenylprop-2-enylidene]-5-methoxy-2,2-bis(3-methylbut-2-enyl)cyclohex-4-ene-1,3-dione.
Chemical Property Profile of Tunicatachalcone
Property Insights of Tunicatachalcone
The XLogP value of 6.4 indicates that Tunicatachalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Tunicatachalcone. Following Lipinski's Rule of Five, Tunicatachalcone has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tunicatachalcone?
The CAS number of Tunicatachalcone is 329038-96-2.
What is the molecular formula of Tunicatachalcone?
The molecular formula of Tunicatachalcone is C26H30O4.
What is the molecular weight of Tunicatachalcone?
The molecular weight of Tunicatachalcone is 406.21 g/mol.
Where can I buy Tunicatachalcone?
You can request a quote for Tunicatachalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tunicatachalcone?
Yes, KEHONG BIO provides custom synthesis services for Tunicatachalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.