Daisazin
TL;DR: Daisazin (CAS 67-16-3) is a chemical compound with molecular formula C24H34N8O4S2 and molecular weight 562.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[3-[[2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-hydroxypent-2-en-3-yl]disulfanyl]-5-hydroxypent-2-en-2-yl]formamide
Also Known As: thiamine disulfide, Algoneurina, Daisazin, Daiomin, aneurin disulfide
| Molecular Formula | C24H34N8O4S2 |
|---|---|
| Molecular Weight | 562.21 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 235.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 562.2144 |
| Heavy Atoms | 38 |
| Complexity | 767.0 |
Chemical Identifiers
| CAS Number | 67-16-3 |
|---|---|
| SMILES | CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCO)SSC(=C(C)N(CC2=CN=C(N=C2N)C)C=O)CCO)C |
| InChIKey | GFEGEDUIIYDMOX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Daisazin (CAS 67-16-3), with molecular formula C24H34N8O4S2 and molecular weight 562.21 g/mol. IUPAC: N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[3-[[2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-hydroxypent-2-en-3-yl]disulfanyl]-5-hydroxypent-2-en-2-yl]formamide.
Chemical Property Profile of Daisazin
Property Insights of Daisazin
The XLogP value of -0.5 indicates that Daisazin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 235.0 Ų indicates high polarity, suggesting Daisazin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Daisazin has 4 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 Daisazin?
The CAS number of Daisazin is 67-16-3.
What is the molecular formula of Daisazin?
The molecular formula of Daisazin is C24H34N8O4S2.
What is the molecular weight of Daisazin?
The molecular weight of Daisazin is 562.21 g/mol.
Where can I buy Daisazin?
You can request a quote for Daisazin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Daisazin?
Yes, KEHONG BIO provides custom synthesis services for Daisazin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.