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Buflomedil pyridoxal phosphate structure
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Buflomedil pyridoxal phosphate

TL;DR: Buflomedil pyridoxal phosphate (CAS 104018-19-1) is a chemical compound with molecular formula C25H35N2O10P and molecular weight 554.20294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl dihydrogen phosphate;4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one

Also Known As: buflomedil pyridoxal phosphate, KST-1A0613, (4-Formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate 4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one, 018B077, 2,4,6-trimethoxyphenyl-3-pyrrolidine propyl ketone

CAS Number
104018-19-1
Molecular Formula
C25H35N2O10P
Molecular Weight
554.20294 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

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

Technical Specifications

Molecular FormulaC25H35N2O10P
Molecular Weight554.20294 g/mol
XLogP3.28852
Topological Polar Surface Area (TPSA)165.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors12
Rotatable Bonds12
Exact Mass554.20294 Da
Heavy Atoms38
Complexity622.0
SMILESCC1=NC=C(C(=C1O)C=O)COP(=O)(O)O.COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC
InChIKeyPFDMMTLRXJOJAK-UHFFFAOYSA-N

Chemical Property Profile of Buflomedil pyridoxal phosphate

XLogP
3.28852
TPSA (Topological Polar Surface Area)
165.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
12
Rotatable Bonds
12
Heavy Atoms
38
Complexity
622.0
Exact Mass
554.20294
Monoisotopic Mass
554.20294
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 Buflomedil pyridoxal phosphate

The XLogP value of 3.28852 indicates that Buflomedil pyridoxal phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 165.0 Ų indicates high polarity, suggesting Buflomedil pyridoxal phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Buflomedil pyridoxal phosphate has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Buflomedil pyridoxal phosphate?

The CAS number of Buflomedil pyridoxal phosphate is 104018-19-1.

What is the molecular formula of Buflomedil pyridoxal phosphate?

The molecular formula of Buflomedil pyridoxal phosphate is C25H35N2O10P.

What is the molecular weight of Buflomedil pyridoxal phosphate?

The molecular weight of Buflomedil pyridoxal phosphate is 554.20294 g/mol.

Where can I buy Buflomedil pyridoxal phosphate?

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

Does CoreyChem offer custom synthesis for Buflomedil pyridoxal phosphate?

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

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