![4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate structure](/static/products/892/892638-91-4.png)
4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate
TL;DR: 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate (CAS 892638-91-4) is a chemical compound with molecular formula C16H17NO4 and molecular weight 287.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl] acetate
Also Known As: (Z)-4-(3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl)phenyl acetate, 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate, [4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl] acetate
| Molecular Formula | C16H17NO4 |
|---|---|
| Molecular Weight | 287.12 g/mol |
| LogP | 2.4576 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.11575 |
| Heavy Atoms | 21 |
| Complexity | 613.66907 |
Chemical Identifiers
| CAS Number | 892638-91-4 |
|---|---|
| SMILES | CC(C)/C=C\1/CC(=O)N(C1=O)C2=CC=C(C=C2)OC(=O)C |
Product Overview
4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate (CAS 892638-91-4), with molecular formula C16H17NO4 and molecular weight 287.12 g/mol. IUPAC: [4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl] acetate.
Chemical Property Profile of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate
Property Insights of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate
The XLogP value of 2.4576 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate. Following Lipinski's Rule of Five, 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate has 0 hydrogen bond donor(s) and 4 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-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate?
The CAS number of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate is 892638-91-4.
What is the molecular formula of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate?
The molecular formula of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate is C16H17NO4.
What is the molecular weight of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate?
The molecular weight of 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate is 287.12 g/mol.
Where can I buy 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate?
You can request a quote for 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3Z)-3-(2-methylpropylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.