1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-
TL;DR: 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- (CAS 66596-56-3) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-ol
Also Known As: 5-23-02-00543 (Beilstein Handbook Reference), 1-Piperazinepropanol, alpha-(2-(1,3-benzodioxol-5-yl)ethenyl)-beta,4-dimethyl-, 4-Methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-1-penten-3-ol, 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-, (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-ol
| Molecular Formula | C18H26N2O3 |
|---|---|
| Molecular Weight | 318.19 g/mol |
| LogP | 1.6729 |
| Topological Polar Surface Area | 45.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.19434 |
| Heavy Atoms | 23 |
| Complexity | 553.1977 |
Chemical Identifiers
| CAS Number | 66596-56-3 |
|---|---|
| SMILES | CC(CN1CCN(CC1)C)C(/C=C/C2=CC3=C(C=C2)OCO3)O |
Product Overview
1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- (CAS 66596-56-3), with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol. IUPAC: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-ol.
Chemical Property Profile of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-
Property Insights of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-
The XLogP value of 1.6729 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-. With a topological polar surface area (TPSA) of 45.17 Ų, 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- has 1 hydrogen bond donor(s) and 5 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 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-?
The CAS number of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- is 66596-56-3.
What is the molecular formula of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-?
The molecular formula of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- is C18H26N2O3.
What is the molecular weight of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-?
The molecular weight of 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- is 318.19 g/mol.
Where can I buy 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-?
You can request a quote for 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Penten-3-ol, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.