1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-
TL;DR: 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- (CAS 49646-24-4) is a chemical compound with molecular formula C28H36Cl2N2O3 and molecular weight 518.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]naphthalen-2-yl]propan-1-one;dihydrochloride
Also Known As: 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-, 1-(1-{3-[4-(3,4-Dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy}naphthalen-2-yl)propan-1-one--hydrogen chloride (1/2), 1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]naphthalen-2-yl]propan-1-one dihydrochloride, RefChem:234730
| Molecular Formula | C28H36Cl2N2O3 |
|---|---|
| Molecular Weight | 518.21 g/mol |
| LogP | 5.45484 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 518.2103 |
| Heavy Atoms | 35 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 49646-24-4 |
|---|---|
| SMILES | CCC(=O)C1=C(C2=CC=CC=C2C=C1)OCC(CN3CCN(CC3)C4=CC(=C(C=C4)C)C)O.Cl.Cl |
| InChIKey | ZWYFUCNQYGDKPK-UHFFFAOYSA-N |
Product Overview
1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- (CAS 49646-24-4), with molecular formula C28H36Cl2N2O3 and molecular weight 518.21 g/mol. IUPAC: 1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]naphthalen-2-yl]propan-1-one;dihydrochloride.
Chemical Property Profile of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-
Property Insights of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-
The XLogP value of 5.45484 indicates that 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-?
The CAS number of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- is 49646-24-4.
What is the molecular formula of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-?
The molecular formula of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- is C28H36Cl2N2O3.
What is the molecular weight of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-?
The molecular weight of 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- is 518.21 g/mol.
Where can I buy 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-?
You can request a quote for 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 1-(1-(3-(4-(3,4-dimethylphenyl)-1-piperazinyl)-2-hydroxypropoxy)-2-naphthalenyl)-, dihydrochloride, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.