Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride
TL;DR: Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride (CAS 98897-35-9) is a chemical compound with molecular formula C15H24Cl2N2O and molecular weight 318.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylpiperazin-1-yl)-1-phenylbutan-1-one;dihydrochloride
Also Known As: 1-(Benzoilopropylo)-4-metylo-piperazyna 2HCl, 4-(4-Methyl-1-piperazinyl)butyrophenone dihydrochloride, 1-(Benzoilopropylo)-4-metylo-piperazyna 2HCl [Polish], BUTYROPHENONE, 4-(4-METHYL-1-PIPERAZINYL)-, DIHYDROCHLORIDE, 4-(4-methylpiperazin-1-yl)-1-phenyl-butan-1-one dihydrochloride
| Molecular Formula | C15H24Cl2N2O |
|---|---|
| Molecular Weight | 318.13 g/mol |
| LogP | 2.74 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.12656 |
| Heavy Atoms | 20 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 98897-35-9 |
|---|---|
| SMILES | CN1CCN(CC1)CCCC(=O)C2=CC=CC=C2.Cl.Cl |
| InChIKey | OYADLSAPZVVSMD-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride (CAS 98897-35-9), with molecular formula C15H24Cl2N2O and molecular weight 318.13 g/mol. IUPAC: 4-(4-methylpiperazin-1-yl)-1-phenylbutan-1-one;dihydrochloride.
Chemical Property Profile of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride
Property Insights of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride
The XLogP value of 2.74 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride. With a topological polar surface area (TPSA) of 23.6 Ų, Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride has 2 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 Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride?
The CAS number of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride is 98897-35-9.
What is the molecular formula of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride?
The molecular formula of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride is C15H24Cl2N2O.
What is the molecular weight of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride?
The molecular weight of Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride is 318.13 g/mol.
Where can I buy Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride?
You can request a quote for Butyrophenone, 4-(4-methyl-1-piperazinyl)-, 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-methyl-1-piperazinyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 4-(4-methyl-1-piperazinyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.