黄酮哌酯
TL;DR: 黄酮哌酯 (CAS 15301-69-6) is a chemical compound with molecular formula C24H25NO4 and molecular weight 391.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
黄酮哌酯
2-piperidin-1-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate
Also Known As: flavoxate, Flavoxato, Urispas, Flavoxatum, Flavossato
| Molecular Formula | C24H25NO4 |
|---|---|
| Molecular Weight | 391.18 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.17834 |
| Heavy Atoms | 29 |
| Complexity | 631.0 |
| Melting Point | 232-234 |
| Solubility | 10 |
Chemical Identifiers
| CAS Number | 15301-69-6 |
|---|---|
| SMILES | CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCN3CCCCC3)C4=CC=CC=C4 |
| InChIKey | SPIUTQOUKAMGCX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
黄酮哌酯 (CAS 15301-69-6), with molecular formula C24H25NO4 and molecular weight 391.18 g/mol. IUPAC: 2-piperidin-1-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate.
Chemical Property Profile of 黄酮哌酯
Property Insights of 黄酮哌酯
The XLogP value of 4.3 indicates that 黄酮哌酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 黄酮哌酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 黄酮哌酯 has 0 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 黄酮哌酯?
The CAS number of 黄酮哌酯 is 15301-69-6.
What is the molecular formula of 黄酮哌酯?
The molecular formula of 黄酮哌酯 is C24H25NO4.
What is the molecular weight of 黄酮哌酯?
The molecular weight of 黄酮哌酯 is 391.18 g/mol.
Where can I buy 黄酮哌酯?
You can request a quote for 黄酮哌酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 黄酮哌酯?
Yes, KEHONG BIO provides custom synthesis services for 黄酮哌酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.