![[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate structure](/static/products/452/452344-30-8.png)
[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate
TL;DR: [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate (CAS 452344-30-8) is a chemical compound with molecular formula C21H10ClF3O4S and molecular weight 449.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] thiophene-2-carboxylate
Also Known As: [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate|3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl thiophene-2-carboxylate|3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl thiophene-2-carboxyla te
| Molecular Formula | C21H10ClF3O4S |
|---|---|
| Molecular Weight | 449.99 g/mol |
| LogP | 6.4129 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 449.99405 |
| Heavy Atoms | 30 |
| Complexity | 1293.0735 |
Chemical Identifiers
| CAS Number | 452344-30-8 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=C(C=C4)Cl |
Product Overview
[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate (CAS 452344-30-8), with molecular formula C21H10ClF3O4S and molecular weight 449.99 g/mol. IUPAC: [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] thiophene-2-carboxylate.
Chemical Property Profile of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate
Property Insights of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate
The XLogP value of 6.4129 indicates that [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate?
The CAS number of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate is 452344-30-8.
What is the molecular formula of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate?
The molecular formula of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate is C21H10ClF3O4S.
What is the molecular weight of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate?
The molecular weight of [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate is 449.99 g/mol.
Where can I buy [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate?
You can request a quote for [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] Thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.