Acuminatin
TL;DR: Acuminatin (CAS 41744-39-2) is a chemical compound with molecular formula C21H24O4 and molecular weight 340.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-prop-1-enyl-2,3-dihydro-1-benzofuran
Also Known As: Acuminatin
| Molecular Formula | C21H24O4 |
|---|---|
| Molecular Weight | 340.17 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.16745 |
| Heavy Atoms | 25 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 41744-39-2 |
|---|---|
| SMILES | CC=CC1=CC2=C(C(=C1)OC)O[C@H]([C@@H]2C)C3=CC(=C(C=C3)OC)OC |
| InChIKey | ITFKWUHXYCXXFF-ZUOKHONESA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acuminatin (CAS 41744-39-2), with molecular formula C21H24O4 and molecular weight 340.17 g/mol. IUPAC: (2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-prop-1-enyl-2,3-dihydro-1-benzofuran.
Chemical Property Profile of Acuminatin
Property Insights of Acuminatin
The XLogP value of 4.7 indicates that Acuminatin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, Acuminatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acuminatin has 0 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 Acuminatin?
The CAS number of Acuminatin is 41744-39-2.
What is the molecular formula of Acuminatin?
The molecular formula of Acuminatin is C21H24O4.
What is the molecular weight of Acuminatin?
The molecular weight of Acuminatin is 340.17 g/mol.
Where can I buy Acuminatin?
You can request a quote for Acuminatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acuminatin?
Yes, KEHONG BIO provides custom synthesis services for Acuminatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.