Diffutin
TL;DR: Diffutin (CAS 89289-91-8) is a chemical compound with molecular formula C23H28O10 and molecular weight 464.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-2-[[(2S)-2-(3,4-dimethoxyphenyl)-7-hydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Diffutin, (2S,3R,4S,5S,6R)-2-[[(2S)-2-(3,4-dimethoxyphenyl)-7-hydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol, (2S)-2-(3,4-dimethoxyphenyl)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-5-yl beta-D-glucopyranoside, (2S,3R,4S,5S,6R)-2-{[(2S)-2-(3,4-dimethoxyphenyl)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol, (2S)-2-(3,4-Dimethoxyphenyl)-7-hydroxy-3,4-dihydro-2H-chromen-5-yl beta-D-glucopyranoside
| Molecular Formula | C23H28O10 |
|---|---|
| Molecular Weight | 464.17 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.16824 |
| Heavy Atoms | 33 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 89289-91-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[C@@H]2CCC3=C(O2)C=C(C=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)OC |
| InChIKey | ZNWIOJJMPZWSQO-YRDUZITASA-N |
Product Overview
Diffutin (CAS 89289-91-8), with molecular formula C23H28O10 and molecular weight 464.17 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[[(2S)-2-(3,4-dimethoxyphenyl)-7-hydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Diffutin
Property Insights of Diffutin
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diffutin. The TPSA of 147.0 Ų indicates high polarity, suggesting Diffutin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diffutin has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diffutin?
The CAS number of Diffutin is 89289-91-8.
What is the molecular formula of Diffutin?
The molecular formula of Diffutin is C23H28O10.
What is the molecular weight of Diffutin?
The molecular weight of Diffutin is 464.17 g/mol.
Where can I buy Diffutin?
You can request a quote for Diffutin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diffutin?
Yes, KEHONG BIO provides custom synthesis services for Diffutin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.