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1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one
TL;DR: 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one (CAS 1859-60-5) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one
Also Known As: 1-acetyl-3-(4-methoxybenzylidene)pyrrolidin-2-one, 1-acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 1859-60-5 |
|---|---|
| SMILES | CC(=O)N1CCC(=CC2=CC=C(C=C2)OC)C1=O |
| InChIKey | RQUUOXDOEVQTQP-UHFFFAOYSA-N |
Product Overview
1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one (CAS 1859-60-5), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: 1-acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one.
Chemical Property Profile of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one
Property Insights of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one. With a topological polar surface area (TPSA) of 46.6 Ų, 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one has 0 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 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one?
The CAS number of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one is 1859-60-5.
What is the molecular formula of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one?
The molecular formula of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one is C14H15NO3.
What is the molecular weight of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one?
The molecular weight of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one is 245.11 g/mol.
Where can I buy 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one?
You can request a quote for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.