Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)
TL;DR: Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) (CAS 21820-62-2) is a chemical compound with molecular formula C21H24N2O6 and molecular weight 400.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-oxoacetate;(1-methylpyrrolidin-3-yl)-(2-phenoxyacetyl)-phenylazanium
Also Known As: N-(1-Methyl-3-pyrrolidinyl)-2-phenoxyacetanilide oxalate (1:1), ACETANILIDE, N-(1-METHYL-3-PYRROLIDINYL)-2-PHENOXY-, OXALATE (1:1), 2-hydroxy-2-oxoacetate; (1-methylpyrrolidin-3-yl)-(2-phenoxyacetyl)-phenylazanium, RefChem:1075482
| Molecular Formula | C21H24N2O6 |
|---|---|
| Molecular Weight | 400.16 g/mol |
| LogP | -0.67 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.16342 |
| Heavy Atoms | 29 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 21820-62-2 |
|---|---|
| SMILES | CN1CCC(C1)[NH+](C2=CC=CC=C2)C(=O)COC3=CC=CC=C3.C(=O)(C(=O)[O-])O |
| InChIKey | PZIPWGXJQPOTGL-UHFFFAOYSA-N |
Product Overview
Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) (CAS 21820-62-2), with molecular formula C21H24N2O6 and molecular weight 400.16 g/mol. IUPAC: 2-hydroxy-2-oxoacetate;(1-methylpyrrolidin-3-yl)-(2-phenoxyacetyl)-phenylazanium.
Chemical Property Profile of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)
Property Insights of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)
The XLogP value of -0.67 indicates that Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1). Following Lipinski's Rule of Five, Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) has 2 hydrogen bond donor(s) and 7 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 Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)?
The CAS number of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) is 21820-62-2.
What is the molecular formula of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)?
The molecular formula of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) is C21H24N2O6.
What is the molecular weight of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)?
The molecular weight of Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) is 400.16 g/mol.
Where can I buy Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)?
You can request a quote for Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Acetanilide, N-(1-methyl-3-pyrrolidinyl)-2-phenoxy-, oxalate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.