4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate
TL;DR: 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate (CAS 433308-02-2) is a chemical compound with molecular formula C18H16O5S and molecular weight 344.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethyl-2-oxochromen-7-yl) 4-methylbenzenesulfonate
Also Known As: EiM07-13511, 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate, (4-ethyl-2-oxochromen-7-yl) 4-methylbenzenesulfonate, 4-ethyl-7-(4-methylphenyl)sulfonyloxy-chromen-2-one, 4-ETHYL-2-OXO-2H-CHROMEN-7-YL 4-METHYL-1-BENZENESULFONATE
| Molecular Formula | C18H16O5S |
|---|---|
| Molecular Weight | 344.07 g/mol |
| LogP | 3.43152 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.07184 |
| Heavy Atoms | 24 |
| Complexity | 1046.9545 |
Chemical Identifiers
| CAS Number | 433308-02-2 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate (CAS 433308-02-2), with molecular formula C18H16O5S and molecular weight 344.07 g/mol. IUPAC: (4-ethyl-2-oxochromen-7-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate
Property Insights of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate
The XLogP value of 3.43152 indicates that 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate. Following Lipinski's Rule of Five, 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate 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 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate?
The CAS number of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate is 433308-02-2.
What is the molecular formula of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate?
The molecular formula of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate is C18H16O5S.
What is the molecular weight of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate?
The molecular weight of 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate is 344.07 g/mol.
Where can I buy 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate?
You can request a quote for 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl-2-oxo-2H-chromen-7-yl 4-methylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.