盐酸黄酮哌酯
TL;DR: 盐酸黄酮哌酯 (CAS 183133-96-2) is a chemical compound with molecular formula C24H26ClNO4 and molecular weight 427.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
盐酸黄酮哌酯
2-piperidin-1-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate;hydrochloride
Also Known As: Flavoxate hydrochloride, Flavoxate HCL, Urispas, Spasmal, Bladderon
| Molecular Formula | C24H26ClNO4 |
|---|---|
| Molecular Weight | 427.16 g/mol |
| LogP | 4.83292 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.15503 |
| Heavy Atoms | 30 |
| Complexity | 631.0 |
Chemical Identifiers
| CAS Number | 183133-96-2 |
|---|---|
| SMILES | CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCN3CCCCC3)C4=CC=CC=C4.Cl |
| InChIKey | XOEVKNFZUQEERE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
盐酸黄酮哌酯 (CAS 183133-96-2), with molecular formula C24H26ClNO4 and molecular weight 427.16 g/mol. IUPAC: 2-piperidin-1-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate;hydrochloride.
Chemical Property Profile of 盐酸黄酮哌酯
Property Insights of 盐酸黄酮哌酯
The XLogP value of 4.83292 indicates that 盐酸黄酮哌酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 盐酸黄酮哌酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 盐酸黄酮哌酯 has 1 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 盐酸黄酮哌酯?
The CAS number of 盐酸黄酮哌酯 is 183133-96-2.
What is the molecular formula of 盐酸黄酮哌酯?
The molecular formula of 盐酸黄酮哌酯 is C24H26ClNO4.
What is the molecular weight of 盐酸黄酮哌酯?
The molecular weight of 盐酸黄酮哌酯 is 427.16 g/mol.
Where can I buy 盐酸黄酮哌酯?
You can request a quote for 盐酸黄酮哌酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 盐酸黄酮哌酯?
Yes, KEHONG BIO provides custom synthesis services for 盐酸黄酮哌酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.