Heliettin
TL;DR: Heliettin (CAS 33054-89-6) is a chemical compound with molecular formula C19H20O4 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)furo[3,2-g]chromen-7-one
Also Known As: Heliettin, 7H-Furo(3,2-g)(1)benzopyran-7-one, 6-(1,1-dimethyl-2,3-dihydro-2-propenyl)-2-(1-hydroxy-1-methylethyl)-, (+-)-, 2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)furo[3,2-g]chromen-7-one, BRZ
| Molecular Formula | C19H20O4 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.13617 |
| Heavy Atoms | 23 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 33054-89-6 |
|---|---|
| SMILES | CC(C)(C=C)C1=CC2=CC3=C(C=C2OC1=O)OC(=C3)C(C)(C)O |
| InChIKey | KSNPKTGFQPLZJN-UHFFFAOYSA-N |
Product Overview
Heliettin (CAS 33054-89-6), with molecular formula C19H20O4 and molecular weight 312.14 g/mol. IUPAC: 2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)furo[3,2-g]chromen-7-one.
Chemical Property Profile of Heliettin
Property Insights of Heliettin
The XLogP value of 4.0 indicates that Heliettin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.7 Ų, Heliettin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heliettin has 1 hydrogen bond donor(s) and 4 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 Heliettin?
The CAS number of Heliettin is 33054-89-6.
What is the molecular formula of Heliettin?
The molecular formula of Heliettin is C19H20O4.
What is the molecular weight of Heliettin?
The molecular weight of Heliettin is 312.14 g/mol.
Where can I buy Heliettin?
You can request a quote for Heliettin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heliettin?
Yes, KEHONG BIO provides custom synthesis services for Heliettin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.