N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride
TL;DR: N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride (CAS 98608-59-4) is a chemical compound with molecular formula C18H27ClN2O and molecular weight 322.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-methyl-4-(3-phenylprop-2-enyl)piperazin-1-yl]butan-1-one;hydrochloride
Also Known As: N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride, 1-[2-Methyl-4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]butan-1-one hydrochloride (1:1), 1-[2-methyl-4-(3-phenylprop-2-enyl)piperazin-1-yl]butan-1-one hydrochloride, 1-Butanone, 1-[2-methyl-4-(3-phenyl-2-propen-1-yl)-1-piperazinyl]-, hydrochloride (1:1); Piperazine, 2-methyl-1-(1-oxobutyl)-4-(3-phenyl-2-propenyl)-, monohydrochloride (9CI); 1-[2-Methyl-4-(3-phenyl-2-propen-1-yl)-1-piperazinyl]-1-butanone hydrochloride; 2-Methyl-AP-237 hydrochloride; 2-Methylbucinnazine hydrochloride; 2-Methyl bucinnazine; 1-[2-Methyl-4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]butan-1-one monohydrochloride
| Molecular Formula | C18H27ClN2O |
|---|---|
| Molecular Weight | 322.18 g/mol |
| LogP | 3.4544 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.18118 |
| Heavy Atoms | 22 |
| Complexity | 475.23532 |
Chemical Identifiers
| CAS Number | 98608-59-4 |
|---|---|
| SMILES | CCCC(=O)N1CCN(CC1C)CC=CC2=CC=CC=C2.Cl |
Product Overview
N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride (CAS 98608-59-4), with molecular formula C18H27ClN2O and molecular weight 322.18 g/mol. IUPAC: 1-[2-methyl-4-(3-phenylprop-2-enyl)piperazin-1-yl]butan-1-one;hydrochloride.
Chemical Property Profile of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride
Property Insights of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride
The XLogP value of 3.4544 indicates that N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride has 0 hydrogen bond donor(s) and 2 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 N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride?
The CAS number of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride is 98608-59-4.
What is the molecular formula of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride?
The molecular formula of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride is C18H27ClN2O.
What is the molecular weight of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride?
The molecular weight of N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride is 322.18 g/mol.
Where can I buy N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride?
You can request a quote for N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.