3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione
TL;DR: 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione (CAS 75960-79-1) is a chemical compound with molecular formula C21H18O3S and molecular weight 350.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-yl)-6-ethyl-7-methoxy-2-methylchromene-4-thione
Also Known As: 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione, 3-(1-benzofuran-2-yl)-6-ethyl-7-methoxy-2-methylchromene-4-thione
| Molecular Formula | C21H18O3S |
|---|---|
| Molecular Weight | 350.10 g/mol |
| LogP | 6.45491 |
| Topological Polar Surface Area | 35.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.09766 |
| Heavy Atoms | 25 |
| Complexity | 1118.1885 |
Chemical Identifiers
| CAS Number | 75960-79-1 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OC)OC(=C(C2=S)C3=CC4=CC=CC=C4O3)C |
Product Overview
3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione (CAS 75960-79-1), with molecular formula C21H18O3S and molecular weight 350.10 g/mol. IUPAC: 3-(1-benzofuran-2-yl)-6-ethyl-7-methoxy-2-methylchromene-4-thione.
Chemical Property Profile of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione
Property Insights of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione
The XLogP value of 6.45491 indicates that 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.51 Ų, 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione has 0 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 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione?
The CAS number of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione is 75960-79-1.
What is the molecular formula of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione?
The molecular formula of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione is C21H18O3S.
What is the molecular weight of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione?
The molecular weight of 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione is 350.10 g/mol.
Where can I buy 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione?
You can request a quote for 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzofuran-2-yl)-6-ethyl-7-methoxy-2-methyl-4H-chromene-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.