Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester
TL;DR: Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester (CAS 315216-52-5) is a chemical compound with molecular formula C20H23N3O3 and molecular weight 353.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(E)-(4-phenylpiperazin-1-yl)iminomethyl]phenyl] acetate
Also Known As: BAS 01809355, Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester, (E)-2-methoxy-4-(((4-phenylpiperazin-1-yl)imino)methyl)phenyl acetate, [2-methoxy-4-[(E)-(4-phenylpiperazin-1-yl)iminomethyl]phenyl] acetate, 2-methoxy-4-{(E)-[(4-phenyl-1-piperazinyl)imino]methyl}phenyl acetate
| Molecular Formula | C20H23N3O3 |
|---|---|
| Molecular Weight | 353.17 g/mol |
| LogP | 2.7766 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.17395 |
| Heavy Atoms | 26 |
| Complexity | 769.1258 |
Chemical Identifiers
| CAS Number | 315216-52-5 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)/C=N/N2CCN(CC2)C3=CC=CC=C3)OC |
Product Overview
Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester (CAS 315216-52-5), with molecular formula C20H23N3O3 and molecular weight 353.17 g/mol. IUPAC: [2-methoxy-4-[(E)-(4-phenylpiperazin-1-yl)iminomethyl]phenyl] acetate.
Chemical Property Profile of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester
Property Insights of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester
The XLogP value of 2.7766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester. With a topological polar surface area (TPSA) of 54.37 Ų, Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester has 0 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 Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester?
The CAS number of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester is 315216-52-5.
What is the molecular formula of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester?
The molecular formula of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester is C20H23N3O3.
What is the molecular weight of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester?
The molecular weight of Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester is 353.17 g/mol.
Where can I buy Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester?
You can request a quote for Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 2-methoxy-4-[(4-phenyl-piperazin-1-ylimino)-methyl]-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.