4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one
TL;DR: 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one (CAS 617697-37-7) is a chemical compound with molecular formula C22H20BrNO5 and molecular weight 457.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-(oxolan-2-ylmethyl)pyrrolidine-2,3-dione
Also Known As: 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one, (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-(oxolan-2-ylmethyl)pyrrolidine-2,3-dione, 4-(4-BROMOBENZOYL)-3-HYDROXY-5-(3-HYDROXYPHENYL)-1-(TETRAHYDRO-2-FURANYLMETHYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 4-(4-bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-[(oxolan-2-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one, 644-442-8
| Molecular Formula | C22H20BrNO5 |
|---|---|
| Molecular Weight | 457.05 g/mol |
| LogP | 3.7554 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 457.0525 |
| Heavy Atoms | 29 |
| Complexity | 978.9521 |
Chemical Identifiers
| CAS Number | 617697-37-7 |
|---|---|
| SMILES | C1CC(OC1)CN2C(/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C2=O)C4=CC(=CC=C4)O |
Product Overview
4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one (CAS 617697-37-7), with molecular formula C22H20BrNO5 and molecular weight 457.05 g/mol. IUPAC: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)-1-(oxolan-2-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one
Property Insights of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one
The XLogP value of 3.7554 indicates that 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one has 2 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-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one?
The CAS number of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one is 617697-37-7.
What is the molecular formula of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one?
The molecular formula of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one is C22H20BrNO5.
What is the molecular weight of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one?
The molecular weight of 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one is 457.05 g/mol.
Where can I buy 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one?
You can request a quote for 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Bromobenzoyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.