RefChem:359483
TL;DR: RefChem:359483 (CAS 428504-83-0) is a chemical compound with molecular formula C26H21N3O3S and molecular weight 455.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: N-[[[5-(5-Ethyl-2-benzoxazolyl)-2-methylphenyl]amino]thioxomethyl]-2-benzofurancarboxamide, N-{[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-1-benzofuran-2-carboxamide, N-[[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-1-benzofuran-2-carboxamide, 3-(1-BENZOFURAN-2-CARBONYL)-1-[5-(5-ETHYL-1,3-BENZOXAZOL-2-YL)-2-METHYLPHENYL]THIOUREA, N-(((5-(5-Ethyl-2-benzoxazolyl)-2-methylphenyl)amino)thioxomethyl)-2-benzofurancarboxamide
| Molecular Formula | C26H21N3O3S |
|---|---|
| Molecular Weight | 455.13 g/mol |
| LogP | 6.23862 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.13037 |
| Heavy Atoms | 33 |
| Complexity | 1483.096 |
Chemical Identifiers
| CAS Number | 428504-83-0 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4 |
Product Overview
RefChem:359483 (CAS 428504-83-0), with molecular formula C26H21N3O3S and molecular weight 455.13 g/mol. IUPAC: N-[[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of RefChem:359483
Property Insights of RefChem:359483
The XLogP value of 6.23862 indicates that RefChem:359483 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:359483. Following Lipinski's Rule of Five, RefChem:359483 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:359483?
The CAS number of RefChem:359483 is 428504-83-0.
What is the molecular formula of RefChem:359483?
The molecular formula of RefChem:359483 is C26H21N3O3S.
What is the molecular weight of RefChem:359483?
The molecular weight of RefChem:359483 is 455.13 g/mol.
Where can I buy RefChem:359483?
You can request a quote for RefChem:359483 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:359483?
Yes, KEHONG BIO provides custom synthesis services for RefChem:359483 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.