RefChem:570718
TL;DR: RefChem:570718 (CAS 71205-35-1) is a chemical compound with molecular formula C36H53N3O4 and molecular weight 591.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(3-ethoxy-5-oxo-4H-pyrazol-1-yl)phenyl]-2-(3-pentadecylphenoxy)butanamide
Also Known As: Butanamide, N-[4-(3-ethoxy-4,5-dihydro-5-oxo-1H-pyrazol-1-yl)phenyl]-2-(3-pentadecylphenoxy)-, n-[4-(3-ethoxy-5-oxo-4,5-dihydro-1h-pyrazol-1-yl)phenyl]-2-(3-pentadecylphenoxy)butanamide, 3-Ethoxy-1-(4-(2-(3-pentadecylphenoxy)butyramido)phenyl)-2-pyrazolin-5-one, Butanamide, N-(4-(3-ethoxy-4,5-dihydro-5-oxo-1H-pyrazol-1-yl)phenyl)-2-(3-pentadecylphenoxy)-, 3-Ethoxy-1-[4-[2-(3-pentadecylphenoxy)butanoylamino]phenyl]-2-pyrazolin-5-one
| Molecular Formula | C36H53N3O4 |
|---|---|
| Molecular Weight | 591.40 g/mol |
| LogP | 11.4 |
| Topological Polar Surface Area | 80.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 22 |
| Exact Mass | 591.4036 |
| Heavy Atoms | 43 |
| Complexity | 810.0 |
Chemical Identifiers
| CAS Number | 71205-35-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC=C(C=C2)N3C(=O)CC(=N3)OCC |
| InChIKey | DYWWLRFNCPQXMM-UHFFFAOYSA-N |
Product Overview
RefChem:570718 (CAS 71205-35-1), with molecular formula C36H53N3O4 and molecular weight 591.40 g/mol. IUPAC: N-[4-(3-ethoxy-5-oxo-4H-pyrazol-1-yl)phenyl]-2-(3-pentadecylphenoxy)butanamide.
Chemical Property Profile of RefChem:570718
Property Insights of RefChem:570718
The XLogP value of 11.4 indicates that RefChem:570718 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:570718. Following Lipinski's Rule of Five, RefChem:570718 has 1 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:570718?
The CAS number of RefChem:570718 is 71205-35-1.
What is the molecular formula of RefChem:570718?
The molecular formula of RefChem:570718 is C36H53N3O4.
What is the molecular weight of RefChem:570718?
The molecular weight of RefChem:570718 is 591.40 g/mol.
Where can I buy RefChem:570718?
You can request a quote for RefChem:570718 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:570718?
Yes, KEHONG BIO provides custom synthesis services for RefChem:570718 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.