Danaden retard
TL;DR: Danaden retard (CAS 76391-79-2) is a chemical compound with molecular formula C26H33N3O11S2 and molecular weight 627.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-2,3-dihydroxybutanedioic acid;5-[[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyldisulfanyl]methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol;pyridin-3-ylmethanol
Also Known As: Danaden retard, EP 50/100, (2r,3r)-2,3-dihydroxybutanedioic acid; 5-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyldisulfanylmethyl]-4-(hydroxymethyl)-2-methyl-pyridin-3-ol; 3-pyridylmethanol, (2R,3R)-2,3-dihydroxybutanedioic acid; 5-[[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyldisulfanyl]methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol; pyridin-3-ylmethanol, 3-Pyridinemethanol, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1) (salt), mixt. with 3,3'-(dithiobis(methylene))bis(5-hydroxy-6-methyl-4-pyridinemethanol)
| Molecular Formula | C26H33N3O11S2 |
|---|---|
| Molecular Weight | 627.16 g/mol |
| LogP | 1.02214 |
| Topological Polar Surface Area | 305.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 627.15564 |
| Heavy Atoms | 42 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 76391-79-2 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)CO)CSSCC2=CN=C(C(=C2CO)O)C.C1=CC(=CN=C1)CO.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
| InChIKey | RAQWFNMBUPUYRM-CEAXSRTFSA-N |
Product Overview
Danaden retard (CAS 76391-79-2), with molecular formula C26H33N3O11S2 and molecular weight 627.16 g/mol. IUPAC: (2R,3R)-2,3-dihydroxybutanedioic acid;5-[[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyldisulfanyl]methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol;pyridin-3-ylmethanol.
Chemical Property Profile of Danaden retard
Property Insights of Danaden retard
The XLogP value of 1.02214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Danaden retard. The TPSA of 305.0 Ų indicates high polarity, suggesting Danaden retard may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Danaden retard has 9 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Danaden retard?
The CAS number of Danaden retard is 76391-79-2.
What is the molecular formula of Danaden retard?
The molecular formula of Danaden retard is C26H33N3O11S2.
What is the molecular weight of Danaden retard?
The molecular weight of Danaden retard is 627.16 g/mol.
Where can I buy Danaden retard?
You can request a quote for Danaden retard directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Danaden retard?
Yes, KEHONG BIO provides custom synthesis services for Danaden retard and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.