![4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one structure](/static/products/623/623133-62-0.png)
4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one
TL;DR: 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one (CAS 623133-62-0) is a chemical compound with molecular formula C24H17BrN2O5 and molecular weight 492.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-5-(3-bromophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-5-(3-bromophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione, 4-(1,3-benzodioxol-5-ylcarbonyl)-5-(3-bromophenyl)-3-hydroxy-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one, 4-(2H-benzo[3,4-d]1,3-dioxolan-5-ylcarbonyl)-5-(3-bromophenyl)-3-hydroxy-1-(3- pyridylmethyl)-3-pyrrolin-2-one
| Molecular Formula | C24H17BrN2O5 |
|---|---|
| Molecular Weight | 492.03 g/mol |
| LogP | 4.1947 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 492.03207 |
| Heavy Atoms | 32 |
| Complexity | 1258.2543 |
Chemical Identifiers
| CAS Number | 623133-62-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C(=C\3/C(N(C(=O)C3=O)CC4=CN=CC=C4)C5=CC(=CC=C5)Br)/O |
Product Overview
4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one (CAS 623133-62-0), with molecular formula C24H17BrN2O5 and molecular weight 492.03 g/mol. IUPAC: (4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-5-(3-bromophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one
Property Insights of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one
The XLogP value of 4.1947 indicates that 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one. Following Lipinski's Rule of Five, 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one has 1 hydrogen bond donor(s) and 6 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-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one?
The CAS number of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one is 623133-62-0.
What is the molecular formula of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one?
The molecular formula of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one is C24H17BrN2O5.
What is the molecular weight of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one?
The molecular weight of 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one is 492.03 g/mol.
Where can I buy 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one?
You can request a quote for 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2H-1,3-benzodioxole-5-carbonyl)-5-(3-bromophenyl)-3-hydroxy-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.