(2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid
TL;DR: (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid (CAS 364744-62-7) is a chemical compound with molecular formula C20H17NO4 and molecular weight 335.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid
Also Known As: (E)-3-(3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl)acrylic acid, (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid, (E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid, 3-[3-(3-benzyl-2,5-dioxo-pyrrolidin-1-yl)phenyl]prop-2-enoic Acid
| Molecular Formula | C20H17NO4 |
|---|---|
| Molecular Weight | 335.12 g/mol |
| LogP | 2.9066 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.11575 |
| Heavy Atoms | 25 |
| Complexity | 841.7845 |
Chemical Identifiers
| CAS Number | 364744-62-7 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)C2=CC=CC(=C2)/C=C/C(=O)O)CC3=CC=CC=C3 |
Product Overview
(2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid (CAS 364744-62-7), with molecular formula C20H17NO4 and molecular weight 335.12 g/mol. IUPAC: (E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid.
Chemical Property Profile of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid
Property Insights of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid
The XLogP value of 2.9066 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid. Following Lipinski's Rule of Five, (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid 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 (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid?
The CAS number of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid is 364744-62-7.
What is the molecular formula of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid?
The molecular formula of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid is C20H17NO4.
What is the molecular weight of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid?
The molecular weight of (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid is 335.12 g/mol.
Where can I buy (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid?
You can request a quote for (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[3-(3-benzyl-2,5-dioxopyrrolidin-1-yl)phenyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.