盐酸黄酮哌酯
TL;DR: 盐酸黄酮哌酯 (CAS 3717-88-2) 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-ium-4-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate chloride
Also Known As: Bladderon, Spasuret, Urispadol, Genurin, Peflate
| Molecular Formula | C24H26ClNO4 |
|---|---|
| Molecular Weight | 427.16 g/mol |
| LogP | 0.29 |
| Topological Polar Surface Area | 69.2 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 | 3717-88-2 |
|---|---|
| SMILES | CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCC3CC[NH2+]CC3)C4=CC=CC=C4.[Cl-] |
| InChIKey | QSUPSIPNJWAMQP-UHFFFAOYSA-N |
Product Overview
盐酸黄酮哌酯 (CAS 3717-88-2), with molecular formula C24H26ClNO4 and molecular weight 427.16 g/mol. IUPAC: 2-piperidin-1-ium-4-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate chloride.
Chemical Property Profile of 盐酸黄酮哌酯
Property Insights of 盐酸黄酮哌酯
The XLogP value of 0.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 盐酸黄酮哌酯. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 盐酸黄酮哌酯. 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 3717-88-2.
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.