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Cerebrocrast structure
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Cerebrocrast

TL;DR: Cerebrocrast (CAS 13908-86-6) is a chemical compound with molecular formula C26H35F2NO7 and molecular weight 511.23816 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

bis(2-propoxyethyl) 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Also Known As: Cerebrocrast, Ios 11212, IOS-1.1212, IOS 1.1212, SID:134224077

CAS Number
13908-86-6
Molecular Formula
C26H35F2NO7
Molecular Weight
511.23816 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC26H35F2NO7
Molecular Weight511.23816 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)92.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors10
Rotatable Bonds17
Exact Mass511.23816 Da
Heavy Atoms36
Complexity736.0
SMILESCCCOCCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2OC(F)F)C(=O)OCCOCCC)C)C
InChIKeyASCWBYZMMHUZMQ-UHFFFAOYSA-N

Chemical Property Profile of Cerebrocrast

XLogP
4.5
TPSA (Topological Polar Surface Area)
92.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
10
Rotatable Bonds
17
Heavy Atoms
36
Complexity
736.0
Exact Mass
511.23816
Monoisotopic Mass
511.23816
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 Cerebrocrast

The XLogP value of 4.5 indicates that Cerebrocrast is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Cerebrocrast. Following Lipinski's Rule of Five, Cerebrocrast has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Cerebrocrast?

The CAS number of Cerebrocrast is 13908-86-6.

What is the molecular formula of Cerebrocrast?

The molecular formula of Cerebrocrast is C26H35F2NO7.

What is the molecular weight of Cerebrocrast?

The molecular weight of Cerebrocrast is 511.23816 g/mol.

Where can I buy Cerebrocrast?

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

Does CoreyChem offer custom synthesis for Cerebrocrast?

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

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