RefChem:449524
TL;DR: RefChem:449524 (CAS 476485-76-4) is a chemical compound with molecular formula C30H23ClN4O3S and molecular weight 554.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide
Also Known As: 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide, 2-((5-(4-Chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide, 2-((5-(4-CHLOROPHENYL)-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)-N-(2-METHOXYDIBENZO(B,D)FURAN-3-YL)ACETAMIDE, 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide, 2-[5-(4-chlorophenyl)-4-(4-methylphenyl)(1,2,4-triazol-3-ylthio)]-N-(2-methoxy benzo[3,4-b]benzo[d]furan-3-yl)acetamide
| Molecular Formula | C30H23ClN4O3S |
|---|---|
| Molecular Weight | 554.12 g/mol |
| LogP | 7.53492 |
| Topological Polar Surface Area | 82.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 554.1179 |
| Heavy Atoms | 39 |
| Complexity | 1811.0503 |
Chemical Identifiers
| CAS Number | 476485-76-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C4C5=CC=CC=C5OC4=C3)OC)C6=CC=C(C=C6)Cl |
Product Overview
RefChem:449524 (CAS 476485-76-4), with molecular formula C30H23ClN4O3S and molecular weight 554.12 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide.
Chemical Property Profile of RefChem:449524
Property Insights of RefChem:449524
The XLogP value of 7.53492 indicates that RefChem:449524 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.18 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:449524. Following Lipinski's Rule of Five, RefChem:449524 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:449524?
The CAS number of RefChem:449524 is 476485-76-4.
What is the molecular formula of RefChem:449524?
The molecular formula of RefChem:449524 is C30H23ClN4O3S.
What is the molecular weight of RefChem:449524?
The molecular weight of RefChem:449524 is 554.12 g/mol.
Where can I buy RefChem:449524?
You can request a quote for RefChem:449524 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:449524?
Yes, KEHONG BIO provides custom synthesis services for RefChem:449524 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.