4-Benzyl-7-hydroxy-3-phenylcoumarin
TL;DR: 4-Benzyl-7-hydroxy-3-phenylcoumarin (CAS 80472-58-8) is a chemical compound with molecular formula C22H16O3 and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-7-hydroxy-3-phenylchromen-2-one
Also Known As: 4-BENZYL-7-HYDROXY-3-PHENYLCOUMARIN, 4-benzyl-7-hydroxy-3-phenylchromen-2-one, 7-hydroxy-3-phenyl-4-benzylchromen-2-one, 4-Benzyl-7-hydroxy-3-phenylcoumarin, AldrichCPR, 2H-1-Benzopyran-2-one, 7-hydroxy-3-phenyl-4-(phenylmethyl)-
| Molecular Formula | C22H16O3 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 4.7564 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.10995 |
| Heavy Atoms | 25 |
| Complexity | 1080.7313 |
Chemical Identifiers
| CAS Number | 80472-58-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=C(C(=O)OC3=C2C=CC(=C3)O)C4=CC=CC=C4 |
Product Overview
4-Benzyl-7-hydroxy-3-phenylcoumarin (CAS 80472-58-8), with molecular formula C22H16O3 and molecular weight 328.11 g/mol. IUPAC: 4-benzyl-7-hydroxy-3-phenylchromen-2-one.
Chemical Property Profile of 4-Benzyl-7-hydroxy-3-phenylcoumarin
Property Insights of 4-Benzyl-7-hydroxy-3-phenylcoumarin
The XLogP value of 4.7564 indicates that 4-Benzyl-7-hydroxy-3-phenylcoumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.44 Ų, 4-Benzyl-7-hydroxy-3-phenylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-7-hydroxy-3-phenylcoumarin has 1 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 4-Benzyl-7-hydroxy-3-phenylcoumarin?
The CAS number of 4-Benzyl-7-hydroxy-3-phenylcoumarin is 80472-58-8.
What is the molecular formula of 4-Benzyl-7-hydroxy-3-phenylcoumarin?
The molecular formula of 4-Benzyl-7-hydroxy-3-phenylcoumarin is C22H16O3.
What is the molecular weight of 4-Benzyl-7-hydroxy-3-phenylcoumarin?
The molecular weight of 4-Benzyl-7-hydroxy-3-phenylcoumarin is 328.11 g/mol.
Where can I buy 4-Benzyl-7-hydroxy-3-phenylcoumarin?
You can request a quote for 4-Benzyl-7-hydroxy-3-phenylcoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyl-7-hydroxy-3-phenylcoumarin?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyl-7-hydroxy-3-phenylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.