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4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride structure
Fine Chemical

4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride

TL;DR: 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride (CAS 1052524-92-1) is a chemical compound with molecular formula C23H23ClN4O3 and molecular weight 438.14587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine;hydrochloride

Also Known As: 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride, 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine hydrochloride

CAS Number
1052524-92-1
Molecular Formula
C23H23ClN4O3
Molecular Weight
438.14587 g/mol
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Technical Specifications

Molecular FormulaC23H23ClN4O3
Molecular Weight438.14587 g/mol
XLogP4.15712
Topological Polar Surface Area (TPSA)63.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds3
Exact Mass438.14587 Da
Heavy Atoms31
Complexity601.0
SMILESCC1=NC2=C(C(=N1)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC6=CC=CC=C62.Cl
InChIKeyWQBFPKSQFNVVAH-UHFFFAOYSA-N

Chemical Property Profile of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride

XLogP
4.15712
TPSA (Topological Polar Surface Area)
63.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
3
Heavy Atoms
31
Complexity
601.0
Exact Mass
438.14587
Monoisotopic Mass
438.14587
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride

The XLogP value of 4.15712 indicates that 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride. Following Lipinski's Rule of Five, 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride?

The CAS number of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride is 1052524-92-1.

What is the molecular formula of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride?

The molecular formula of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride is C23H23ClN4O3.

What is the molecular weight of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride?

The molecular weight of 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride is 438.14587 g/mol.

Where can I buy 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride?

You can request a quote for 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride?

Yes, CoreyChem provides custom synthesis services for 4-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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