7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione
TL;DR: 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione (CAS 489463-57-2) is a chemical compound with molecular formula C24H19ClO2S and molecular weight 406.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-6-ethyl-7-phenylmethoxychromene-4-thione
Also Known As: 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione, 3-(2-chlorophenyl)-6-ethyl-7-phenylmethoxychromene-4-thione
| Molecular Formula | C24H19ClO2S |
|---|---|
| Molecular Weight | 406.08 g/mol |
| LogP | 7.62409 |
| Topological Polar Surface Area | 22.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.07944 |
| Heavy Atoms | 28 |
| Complexity | 1182.3177 |
Chemical Identifiers
| CAS Number | 489463-57-2 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OCC3=CC=CC=C3)OC=C(C2=S)C4=CC=CC=C4Cl |
Product Overview
7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione (CAS 489463-57-2), with molecular formula C24H19ClO2S and molecular weight 406.08 g/mol. IUPAC: 3-(2-chlorophenyl)-6-ethyl-7-phenylmethoxychromene-4-thione.
Chemical Property Profile of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione
Property Insights of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione
The XLogP value of 7.62409 indicates that 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-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 22.37 Ų, 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione?
The CAS number of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione is 489463-57-2.
What is the molecular formula of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione?
The molecular formula of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione is C24H19ClO2S.
What is the molecular weight of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione?
The molecular weight of 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione is 406.08 g/mol.
Where can I buy 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione?
You can request a quote for 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-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 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 7-(benzyloxy)-3-(2-chlorophenyl)-6-ethyl-4H-chromene-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.