N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride
TL;DR: N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride (CAS 70070-14-3) is a chemical compound with molecular formula C22H30Cl2N2O3 and molecular weight 440.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-phenylpiperazine;dihydrochloride
Also Known As: N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride, 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)-4-phenylpiperazine dihydrochloride, Piperazine, 1-((3,4-dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)-4-phenyl-, dihydrochloride, 1-[(6,7-Dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-4-phenylpiperazine--hydrogen chloride (1/2), 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-phenylpiperazine dihydrochloride
| Molecular Formula | C22H30Cl2N2O3 |
|---|---|
| Molecular Weight | 440.16 g/mol |
| LogP | 3.9834 |
| Topological Polar Surface Area | 34.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.16336 |
| Heavy Atoms | 29 |
| Complexity | 768.1527 |
Chemical Identifiers
| CAS Number | 70070-14-3 |
|---|---|
| SMILES | COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)C4=CC=CC=C4)OC.Cl.Cl |
Product Overview
N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride (CAS 70070-14-3), with molecular formula C22H30Cl2N2O3 and molecular weight 440.16 g/mol. IUPAC: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-phenylpiperazine;dihydrochloride.
Chemical Property Profile of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride
Property Insights of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride
The XLogP value of 3.9834 indicates that N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.17 Ų, N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride has 0 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 N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride?
The CAS number of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride is 70070-14-3.
What is the molecular formula of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride?
The molecular formula of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride is C22H30Cl2N2O3.
What is the molecular weight of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride?
The molecular weight of N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride is 440.16 g/mol.
Where can I buy N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride?
You can request a quote for N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Phenylpiperazino)-1-methyl-5,6-dimethoxyisochroman dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.