Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate
TL;DR: Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate (CAS 510766-16-2) is a chemical compound with molecular formula C20H28N2O3 and molecular weight 344.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate
Also Known As: ChemDiv2_005383, IDI1_004098, methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate, A2910/0122662, Propionic acid methyl ester, 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxo-
| Molecular Formula | C20H28N2O3 |
|---|---|
| Molecular Weight | 344.21 g/mol |
| LogP | 2.3102 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.21 |
| Heavy Atoms | 25 |
| Complexity | 575.8639 |
Chemical Identifiers
| CAS Number | 510766-16-2 |
|---|---|
| SMILES | COC(=O)C(C1CCCC1)C(=O)N2CCN(CC2)CC3=CC=CC=C3 |
Product Overview
Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate (CAS 510766-16-2), with molecular formula C20H28N2O3 and molecular weight 344.21 g/mol. IUPAC: methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate.
Chemical Property Profile of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate
Property Insights of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate
The XLogP value of 2.3102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate. With a topological polar surface area (TPSA) of 49.85 Ų, Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-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-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate?
The CAS number of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate is 510766-16-2.
What is the molecular formula of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate?
The molecular formula of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate is C20H28N2O3.
What is the molecular weight of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate?
The molecular weight of Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate is 344.21 g/mol.
Where can I buy Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate?
You can request a quote for Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-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-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(4-benzylpiperazin-1-yl)-2-cyclopentyl-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.