2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one
TL;DR: 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one (CAS 5272-54-8) is a chemical compound with molecular formula C21H21N3O and molecular weight 331.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one
Also Known As: 2,5-diphenyl-4-2h-pyrazol-3 -one
| Molecular Formula | C21H21N3O |
|---|---|
| Molecular Weight | 331.17 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.16846 |
| Heavy Atoms | 25 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 5272-54-8 |
|---|---|
| SMILES | C1CCN(CC1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | LIHHMCZSEMOCLV-UHFFFAOYSA-N |
Product Overview
2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one (CAS 5272-54-8), with molecular formula C21H21N3O and molecular weight 331.17 g/mol. IUPAC: 2,5-diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one.
Chemical Property Profile of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one
Property Insights of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one
The XLogP value of 4.2 indicates that 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one has 0 hydrogen bond donor(s) and 3 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 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one?
The CAS number of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one is 5272-54-8.
What is the molecular formula of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one?
The molecular formula of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one is C21H21N3O.
What is the molecular weight of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one?
The molecular weight of 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one is 331.17 g/mol.
Where can I buy 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one?
You can request a quote for 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diphenyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.