Buflomedil pyridoxal phosphate
TL;DR: Buflomedil pyridoxal phosphate (CAS 104018-19-1) is a chemical compound with molecular formula C25H35N2O10P and molecular weight 554.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(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
| Molecular Formula | C25H35N2O10P |
|---|---|
| Molecular Weight | 554.20 g/mol |
| LogP | 3.28852 |
| Topological Polar Surface Area | 165.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 554.20294 |
| Heavy Atoms | 38 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 104018-19-1 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C=O)COP(=O)(O)O.COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC |
| InChIKey | PFDMMTLRXJOJAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Buflomedil pyridoxal phosphate (CAS 104018-19-1), with molecular formula C25H35N2O10P and molecular weight 554.20 g/mol. IUPAC: (4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl dihydrogen phosphate;4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one.
Chemical Property Profile of Buflomedil pyridoxal phosphate
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
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 554.20 g/mol.
Where can I buy Buflomedil pyridoxal phosphate?
You can request a quote for Buflomedil pyridoxal phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Buflomedil pyridoxal phosphate?
Yes, KEHONG BIO provides custom synthesis services for Buflomedil pyridoxal phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.