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Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate
TL;DR: Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate (CAS 303151-72-6) is a chemical compound with molecular formula C14H16Cl2N2O3 and molecular weight 330.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[4-(3,4-dichlorophenyl)piperazin-1-yl]-3-oxopropanoate
Also Known As: Bionet2_000946, methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate, methyl 3-[4-(3,4-dichlorophenyl)piperazin-1-yl]-3-oxopropanoate, Methyl 3-4-(3,4-dichlorophenyl)piperazino-3-oxopropanoate, methyl 3-[4-(3,4-dichlorophenyl)piperazin-1-yl]-3-oxo-propanoate
| Molecular Formula | C14H16Cl2N2O3 |
|---|---|
| Molecular Weight | 330.05 g/mol |
| LogP | 2.2051 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.0538 |
| Heavy Atoms | 21 |
| Complexity | 543.0207 |
Chemical Identifiers
| CAS Number | 303151-72-6 |
|---|---|
| SMILES | COC(=O)CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate (CAS 303151-72-6), with molecular formula C14H16Cl2N2O3 and molecular weight 330.05 g/mol. IUPAC: methyl 3-[4-(3,4-dichlorophenyl)piperazin-1-yl]-3-oxopropanoate.
Chemical Property Profile of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate
Property Insights of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate
The XLogP value of 2.2051 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate. With a topological polar surface area (TPSA) of 49.85 Ų, Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate 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 Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate?
The CAS number of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate is 303151-72-6.
What is the molecular formula of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate?
The molecular formula of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate is C14H16Cl2N2O3.
What is the molecular weight of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate?
The molecular weight of Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate is 330.05 g/mol.
Where can I buy Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate?
You can request a quote for Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.