3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one
TL;DR: 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one (CAS 47375-47-3) is a chemical compound with molecular formula C21H26N2O and molecular weight 322.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one
Also Known As: 2-Methyl-1-phenyl-3-(4-(phenylmethyl)-1-piperazinyl)-1-propanone, 3-(4-benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one, 1-Propanone, 2-methyl-1-phenyl-3-(4-(phenylmethyl)-1-piperazinyl)-, RefChem:1066777
| Molecular Formula | C21H26N2O |
|---|---|
| Molecular Weight | 322.20 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.2045 |
| Heavy Atoms | 24 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 47375-47-3 |
|---|---|
| SMILES | CC(CN1CCN(CC1)CC2=CC=CC=C2)C(=O)C3=CC=CC=C3 |
| InChIKey | ZOLUSXMQTNDPER-UHFFFAOYSA-N |
Product Overview
3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one (CAS 47375-47-3), with molecular formula C21H26N2O and molecular weight 322.20 g/mol. IUPAC: 3-(4-benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one.
Chemical Property Profile of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one
Property Insights of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one
The XLogP value of 3.5 indicates that 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-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 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one?
The CAS number of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one is 47375-47-3.
What is the molecular formula of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one?
The molecular formula of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one is C21H26N2O.
What is the molecular weight of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one?
The molecular weight of 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one is 322.20 g/mol.
Where can I buy 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one?
You can request a quote for 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Benzylpiperazin-1-yl)-2-methyl-1-phenylpropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.