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RefChem:509523 structure
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RefChem:509523

TL;DR: RefChem:509523 (CAS 152459-93-3) is a chemical compound with molecular formula C28H29N7O and molecular weight 479.24335 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[(4-methylpiperazin-1-yl)methyl]-N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide

Also Known As: 1y57, Imatinib and nilotinib derivative 1, 4-[(4-METHYL-1-PIPERAZINYL)METHYL]-N-[3-[[4-(3-PYRIDINYL)-2-PYRIMIDINYL]AMINO]PHENYL]-BENZAMIDE, 4-[(4-METHYLPIPERAZIN-1-YL)METHYL]-N-{3-[(4-PYRIDIN-3-YLPYRIMIDIN-2-YL)AMINO]PHENYL}BENZAMIDE, MPZ

CAS Number
152459-93-3
Molecular Formula
C28H29N7O
Molecular Weight
479.24335 g/mol
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Technical Specifications

Molecular FormulaC28H29N7O
Molecular Weight479.24335 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)86.3 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds7
Exact Mass479.24335 Da
Heavy Atoms36
Complexity677.0
SMILESCN1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)NC4=NC=CC(=N4)C5=CN=CC=C5
InChIKeyJHMBUEWQJDGKGS-UHFFFAOYSA-N

Chemical Property Profile of RefChem:509523

XLogP
3.2
TPSA (Topological Polar Surface Area)
86.3
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
7
Heavy Atoms
36
Complexity
677.0
Exact Mass
479.24335
Monoisotopic Mass
479.24335
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 RefChem:509523

The XLogP value of 3.2 indicates that RefChem:509523 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:509523. Following Lipinski's Rule of Five, RefChem:509523 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:509523?

The CAS number of RefChem:509523 is 152459-93-3.

What is the molecular formula of RefChem:509523?

The molecular formula of RefChem:509523 is C28H29N7O.

What is the molecular weight of RefChem:509523?

The molecular weight of RefChem:509523 is 479.24335 g/mol.

Where can I buy RefChem:509523?

You can request a quote for RefChem:509523 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:509523?

Yes, CoreyChem provides custom synthesis services for RefChem:509523 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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