1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone
TL;DR: 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone (CAS 147523-65-7) is a chemical compound with molecular formula C22H18BrN3O2 and molecular weight 435.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-3-oxo-4,5-diphenylpyrazolidine-1-carboxamide
Also Known As: LY 262691, LY 288513, 1- -4,5-diphenyl-3-pyrazolidinone, 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone, LY 288512
| Molecular Formula | C22H18BrN3O2 |
|---|---|
| Molecular Weight | 435.06 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 435.05823 |
| Heavy Atoms | 28 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 147523-65-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(N(NC2=O)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4 |
| InChIKey | LMUQHXHWJWQXSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone (CAS 147523-65-7), with molecular formula C22H18BrN3O2 and molecular weight 435.06 g/mol. IUPAC: N-(4-bromophenyl)-3-oxo-4,5-diphenylpyrazolidine-1-carboxamide.
Chemical Property Profile of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone
Property Insights of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone
The XLogP value of 4.2 indicates that 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone. Following Lipinski's Rule of Five, 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone has 2 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 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone?
The CAS number of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone is 147523-65-7.
What is the molecular formula of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone?
The molecular formula of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone is C22H18BrN3O2.
What is the molecular weight of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone?
The molecular weight of 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone is 435.06 g/mol.
Where can I buy 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone?
You can request a quote for 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenylaminocarbonyl)-4,5-diphenyl-3-pyrazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.