3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-
TL;DR: 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- (CAS 5538-53-4) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-diphenyl-4-prop-2-enylpyrazolidine-3,5-dione
Also Known As: 4-Allyl-1,2-diphenyl-3,5-pyrazolidinedione, 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-, 4-Allyl-1,2-diphenyl-3,5-dioxopyrazolidine, 1,2-diphenyl-4-(prop-2-en-1-yl)pyrazolidine-3,5-dione, 4-Allyl-1,2-diphenyl-3.5-pyrazolidinedione
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 5538-53-4 |
|---|---|
| SMILES | C=CCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | FCNPWXFVAPWQQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- (CAS 5538-53-4), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: 1,2-diphenyl-4-prop-2-enylpyrazolidine-3,5-dione.
Chemical Property Profile of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-
Property Insights of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-. With a topological polar surface area (TPSA) of 40.6 Ų, 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- has 0 hydrogen bond donor(s) and 2 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 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-?
The CAS number of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- is 5538-53-4.
What is the molecular formula of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-?
The molecular formula of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- is C18H16N2O2.
What is the molecular weight of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-?
The molecular weight of 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- is 292.12 g/mol.
Where can I buy 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-?
You can request a quote for 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Pyrazolidinedione, 4-allyl-1,2-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.