Propinqualin
TL;DR: Propinqualin (CAS 147511-60-2) is a chemical compound with molecular formula C21H24O10 and molecular weight 436.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Propinqualin, (-)-Epiafzelechin-3-O-beta-D-allopyranoside, 2-[[5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol, 5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl hexopyranoside, 2-((5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl)oxy)-6-(hydroxymethyl)oxane-3,4,5-triol
| Molecular Formula | C21H24O10 |
|---|---|
| Molecular Weight | 436.14 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.13693 |
| Heavy Atoms | 31 |
| Complexity | 585.0 |
Chemical Identifiers
| CAS Number | 147511-60-2 |
|---|---|
| SMILES | C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC=C(C=C3)O)OC4C(C(C(C(O4)CO)O)O)O |
| InChIKey | XWMNERHJDTUVJN-UHFFFAOYSA-N |
Product Overview
Propinqualin (CAS 147511-60-2), with molecular formula C21H24O10 and molecular weight 436.14 g/mol. IUPAC: 2-[[5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Propinqualin
Property Insights of Propinqualin
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propinqualin. The TPSA of 169.0 Ų indicates high polarity, suggesting Propinqualin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propinqualin has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propinqualin?
The CAS number of Propinqualin is 147511-60-2.
What is the molecular formula of Propinqualin?
The molecular formula of Propinqualin is C21H24O10.
What is the molecular weight of Propinqualin?
The molecular weight of Propinqualin is 436.14 g/mol.
Where can I buy Propinqualin?
You can request a quote for Propinqualin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propinqualin?
Yes, KEHONG BIO provides custom synthesis services for Propinqualin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.