rac 2,4-O-Dimethylzearalenone
TL;DR: rac 2,4-O-Dimethylzearalenone (CAS 7533-25-7) is a chemical compound with molecular formula C20H26O5 and molecular weight 346.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16,18-dimethoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione
Also Known As: rac 2,4-O-Dimethylzearalenone, 16,18-Dimethoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione, (11E)-14,16-Dimethoxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzox acyclotetradecine-1,7(8H)-dione, 14,16-dimethoxy-3-methyl-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecine-1,7-dione, 15,17-dimethoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),2,15,17-tetraene-7,13-dione
| Molecular Formula | C20H26O5 |
|---|---|
| Molecular Weight | 346.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.178 |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 7533-25-7 |
|---|---|
| SMILES | CC1CCCC(=O)CCCC=CC2=C(C(=CC(=C2)OC)OC)C(=O)O1 |
| InChIKey | MYILAUURZUNHGP-UHFFFAOYSA-N |
Product Overview
rac 2,4-O-Dimethylzearalenone (CAS 7533-25-7), with molecular formula C20H26O5 and molecular weight 346.18 g/mol. IUPAC: 16,18-dimethoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione.
Chemical Property Profile of rac 2,4-O-Dimethylzearalenone
Property Insights of rac 2,4-O-Dimethylzearalenone
The XLogP value of 3.7 indicates that rac 2,4-O-Dimethylzearalenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for rac 2,4-O-Dimethylzearalenone. Following Lipinski's Rule of Five, rac 2,4-O-Dimethylzearalenone has 0 hydrogen bond donor(s) and 5 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 rac 2,4-O-Dimethylzearalenone?
The CAS number of rac 2,4-O-Dimethylzearalenone is 7533-25-7.
What is the molecular formula of rac 2,4-O-Dimethylzearalenone?
The molecular formula of rac 2,4-O-Dimethylzearalenone is C20H26O5.
What is the molecular weight of rac 2,4-O-Dimethylzearalenone?
The molecular weight of rac 2,4-O-Dimethylzearalenone is 346.18 g/mol.
Where can I buy rac 2,4-O-Dimethylzearalenone?
You can request a quote for rac 2,4-O-Dimethylzearalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rac 2,4-O-Dimethylzearalenone?
Yes, KEHONG BIO provides custom synthesis services for rac 2,4-O-Dimethylzearalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.