Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
TL;DR: Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride (CAS 16785-18-5) is a chemical compound with molecular formula C18H30Cl2N2O4 and molecular weight 408.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)butan-1-one;dihydrochloride
Also Known As: 4-(4-Methylpiperazinyl)-3',4',5'-trimethoxybutyrophenone dihydrochloride, BUTYROPHENONE, 4-(4-METHYLPIPERAZINYL)-3',4',5'-TRIMETHOXY-, DIHYDROCHLORIDE, 1-Methyl-4-(3-(3,4,5-trimethoxybenzoyl)propyl)piperazine dihydrochloride, Piperazine, 1-methyl-4-(3-(3,4,5-trimethoxybenzoyl)propyl)-, dihydrochloride, 4-(4-Methylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)butan-1-onedihydrochloride
| Molecular Formula | C18H30Cl2N2O4 |
|---|---|
| Molecular Weight | 408.16 g/mol |
| LogP | 2.77 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 408.15826 |
| Heavy Atoms | 26 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 16785-18-5 |
|---|---|
| SMILES | CN1CCN(CC1)CCCC(=O)C2=CC(=C(C(=C2)OC)OC)OC.Cl.Cl |
| InChIKey | HYFGOIAAMHGUFB-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride (CAS 16785-18-5), with molecular formula C18H30Cl2N2O4 and molecular weight 408.16 g/mol. IUPAC: 4-(4-methylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)butan-1-one;dihydrochloride.
Chemical Property Profile of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
Property Insights of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
The XLogP value of 2.77 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride. With a topological polar surface area (TPSA) of 51.2 Ų, Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride has 2 hydrogen bond donor(s) and 6 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 Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
The CAS number of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is 16785-18-5.
What is the molecular formula of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
The molecular formula of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is C18H30Cl2N2O4.
What is the molecular weight of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
The molecular weight of Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is 408.16 g/mol.
Where can I buy Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
You can request a quote for Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 4-(4-methylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.