4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
TL;DR: 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate (CAS 432005-95-3) is a chemical compound with molecular formula C19H18O5 and molecular weight 326.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-butyl-8-methyl-2-oxochromen-7-yl) furan-2-carboxylate
Also Known As: 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 2-furoate, 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate, (4-butyl-8-methyl-2-oxochromen-7-yl) furan-2-carboxylate
| Molecular Formula | C19H18O5 |
|---|---|
| Molecular Weight | 326.12 g/mol |
| LogP | 4.25622 |
| Topological Polar Surface Area | 69.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.11542 |
| Heavy Atoms | 24 |
| Complexity | 918.8253 |
Chemical Identifiers
| CAS Number | 432005-95-3 |
|---|---|
| SMILES | CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)C3=CC=CO3 |
Product Overview
4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate (CAS 432005-95-3), with molecular formula C19H18O5 and molecular weight 326.12 g/mol. IUPAC: (4-butyl-8-methyl-2-oxochromen-7-yl) furan-2-carboxylate.
Chemical Property Profile of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
Property Insights of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
The XLogP value of 4.25622 indicates that 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate. Following Lipinski's Rule of Five, 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate 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-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
The CAS number of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is 432005-95-3.
What is the molecular formula of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
The molecular formula of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is C19H18O5.
What is the molecular weight of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
The molecular weight of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is 326.12 g/mol.
Where can I buy 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
You can request a quote for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.