4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate
TL;DR: 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate (CAS 449739-23-5) is a chemical compound with molecular formula C22H20O4 and molecular weight 348.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-3-phenylchromen-7-yl) cyclohexanecarboxylate
Also Known As: 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate, VU0510183-1, (4-oxo-3-phenylchromen-7-yl) cyclohexanecarboxylate, 4-oxo-3-phenylchromen-7-yl cyclohexanecarboxylate, (4-oxo-3-phenyl-chromen-7-yl) Cyclohexanecarboxylate
| Molecular Formula | C22H20O4 |
|---|---|
| Molecular Weight | 348.14 g/mol |
| LogP | 4.9457 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.13617 |
| Heavy Atoms | 26 |
| Complexity | 981.94495 |
Chemical Identifiers
| CAS Number | 449739-23-5 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4 |
Product Overview
4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate (CAS 449739-23-5), with molecular formula C22H20O4 and molecular weight 348.14 g/mol. IUPAC: (4-oxo-3-phenylchromen-7-yl) cyclohexanecarboxylate.
Chemical Property Profile of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate
Property Insights of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate
The XLogP value of 4.9457 indicates that 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate has 0 hydrogen bond donor(s) and 4 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-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate?
The CAS number of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate is 449739-23-5.
What is the molecular formula of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate?
The molecular formula of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate is C22H20O4.
What is the molecular weight of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate?
The molecular weight of 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate is 348.14 g/mol.
Where can I buy 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate?
You can request a quote for 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-3-phenyl-4H-chromen-7-yl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.