4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate
TL;DR: 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate (CAS 26405-20-9) is a chemical compound with molecular formula C21H20N2O3 and molecular weight 348.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-hydroxyphenyl)-2-methyl-3-oxoprop-1-enyl]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate
| Molecular Formula | C21H20N2O3 |
|---|---|
| Molecular Weight | 348.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.1474 |
| Heavy Atoms | 26 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 26405-20-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=C(C)C(=O)C3=CC=C(C=C3)O |
| InChIKey | KYDFZVMUDDOOSI-UHFFFAOYSA-N |
Product Overview
4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate (CAS 26405-20-9), with molecular formula C21H20N2O3 and molecular weight 348.15 g/mol. IUPAC: 4-[3-(4-hydroxyphenyl)-2-methyl-3-oxoprop-1-enyl]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate
Property Insights of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate. Following Lipinski's Rule of Five, 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate has 1 hydrogen bond donor(s) and 4 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 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate?
The CAS number of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate is 26405-20-9.
What is the molecular formula of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate?
The molecular formula of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate is C21H20N2O3.
What is the molecular weight of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate?
The molecular weight of 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate is 348.15 g/mol.
Where can I buy 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate?
You can request a quote for 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(p-Hydroxybenzoyl)propenyl)antipyrine hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.