Ptaerochromenol
TL;DR: Ptaerochromenol (CAS 17398-11-7) is a chemical compound with molecular formula C15H14O5 and molecular weight 274.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-2-(hydroxymethyl)-8,8-dimethylpyrano[2,3-h]chromen-4-one
Also Known As: Ptaerochromenol, Perforamone D, Pterochromenol, 5-hydroxy-2-(hydroxymethyl)-8,8-dimethylpyrano[2,3-h]chromen-4-one, 5-hydroxy-2-(hydroxymethyl)-8,8-dimethyl-pyrano[2,3-h]chromen-4-one
| Molecular Formula | C15H14O5 |
|---|---|
| Molecular Weight | 274.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.08414 |
| Heavy Atoms | 20 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 17398-11-7 |
|---|---|
| SMILES | CC1(C=CC2=C(O1)C=C(C3=C2OC(=CC3=O)CO)O)C |
| InChIKey | QLDUXSCWWAQMTC-UHFFFAOYSA-N |
Product Overview
Ptaerochromenol (CAS 17398-11-7), with molecular formula C15H14O5 and molecular weight 274.08 g/mol. IUPAC: 5-hydroxy-2-(hydroxymethyl)-8,8-dimethylpyrano[2,3-h]chromen-4-one.
Chemical Property Profile of Ptaerochromenol
Property Insights of Ptaerochromenol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ptaerochromenol. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ptaerochromenol. Following Lipinski's Rule of Five, Ptaerochromenol has 2 hydrogen bond donor(s) and 5 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 Ptaerochromenol?
The CAS number of Ptaerochromenol is 17398-11-7.
What is the molecular formula of Ptaerochromenol?
The molecular formula of Ptaerochromenol is C15H14O5.
What is the molecular weight of Ptaerochromenol?
The molecular weight of Ptaerochromenol is 274.08 g/mol.
Where can I buy Ptaerochromenol?
You can request a quote for Ptaerochromenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ptaerochromenol?
Yes, KEHONG BIO provides custom synthesis services for Ptaerochromenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.