RefChem:322354
TL;DR: RefChem:322354 (CAS 65339-11-9) is a chemical compound with molecular formula C41H51Cl3N4O4 and molecular weight 768.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]-3-[2-(3-pentadecylphenoxy)butanoylamino]benzamide
Also Known As: Benzamide, N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-3-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]-, Benzamide, N-(4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)-3-((1-oxo-2-(3-pentadecylphenoxy)butyl)amino)-, N-(4,5-Dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)-3-((1-oxo-2-(3-pentadecylphenoxy)butyl)amino)benzamide, N-[5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-[2-(3-pentadecylphenoxy)butanamido]benzamide, n-[5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1h-pyrazol-3-yl]-3-{[2-(3-pentadecylphenoxy)butanoyl]amino}benzamide
| Molecular Formula | C41H51Cl3N4O4 |
|---|---|
| Molecular Weight | 768.30 g/mol |
| LogP | 13.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 22 |
| Exact Mass | 768.2976 |
| Heavy Atoms | 52 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 65339-11-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC=CC(=C2)C(=O)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl |
| InChIKey | DLVYTBVBYGPNNB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:322354 (CAS 65339-11-9), with molecular formula C41H51Cl3N4O4 and molecular weight 768.30 g/mol. IUPAC: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]-3-[2-(3-pentadecylphenoxy)butanoylamino]benzamide.
Chemical Property Profile of RefChem:322354
Property Insights of RefChem:322354
The XLogP value of 13.7 indicates that RefChem:322354 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322354. Following Lipinski's Rule of Five, RefChem:322354 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:322354?
The CAS number of RefChem:322354 is 65339-11-9.
What is the molecular formula of RefChem:322354?
The molecular formula of RefChem:322354 is C41H51Cl3N4O4.
What is the molecular weight of RefChem:322354?
The molecular weight of RefChem:322354 is 768.30 g/mol.
Where can I buy RefChem:322354?
You can request a quote for RefChem:322354 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322354?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322354 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.