Coumarin, 3-benzoyl-4-phenyl-
TL;DR: Coumarin, 3-benzoyl-4-phenyl- (CAS 19725-29-2) is a chemical compound with molecular formula C22H14O3 and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoyl-4-phenylchromen-2-one
Also Known As: Coumarin, 3-benzoyl-4-phenyl-, 3-Benzoyl-4-phenylcoumarin, 3-benzoyl-4-phenylchromen-2-one, 3-Benzoyl-4-phenyl-2H-chromen-2-one, 3-Benzoyl-4-phenyl-3-chromene-2-one
| Molecular Formula | C22H14O3 |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.0943 |
| Heavy Atoms | 25 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 19725-29-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)OC3=CC=CC=C32)C(=O)C4=CC=CC=C4 |
| InChIKey | FMCKKHCHCKODSJ-UHFFFAOYSA-N |
Product Overview
Coumarin, 3-benzoyl-4-phenyl- (CAS 19725-29-2), with molecular formula C22H14O3 and molecular weight 326.09 g/mol. IUPAC: 3-benzoyl-4-phenylchromen-2-one.
Chemical Property Profile of Coumarin, 3-benzoyl-4-phenyl-
Property Insights of Coumarin, 3-benzoyl-4-phenyl-
The XLogP value of 4.6 indicates that Coumarin, 3-benzoyl-4-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Coumarin, 3-benzoyl-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coumarin, 3-benzoyl-4-phenyl- has 0 hydrogen bond donor(s) and 3 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 Coumarin, 3-benzoyl-4-phenyl-?
The CAS number of Coumarin, 3-benzoyl-4-phenyl- is 19725-29-2.
What is the molecular formula of Coumarin, 3-benzoyl-4-phenyl-?
The molecular formula of Coumarin, 3-benzoyl-4-phenyl- is C22H14O3.
What is the molecular weight of Coumarin, 3-benzoyl-4-phenyl-?
The molecular weight of Coumarin, 3-benzoyl-4-phenyl- is 326.09 g/mol.
Where can I buy Coumarin, 3-benzoyl-4-phenyl-?
You can request a quote for Coumarin, 3-benzoyl-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coumarin, 3-benzoyl-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Coumarin, 3-benzoyl-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.