RefChem:448544
TL;DR: RefChem:448544 (CAS 476484-55-6) is a chemical compound with molecular formula C23H17Cl3N4O2S and molecular weight 518.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4-dichlorophenyl)acetamide
Also Known As: 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dichlorophenyl)acetamide, 2-((4-(4-Chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(3,4-dichlorophenyl)acetamide, 2-((4-(4-CHLOROPHENYL)-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)-N-(3,4-DICHLOROPHENYL)ACETAMIDE, 2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4-dichlorophenyl)acetamide, 648-755-0
| Molecular Formula | C23H17Cl3N4O2S |
|---|---|
| Molecular Weight | 518.01 g/mol |
| LogP | 6.6339 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.0138 |
| Heavy Atoms | 33 |
| Complexity | 1278.1185 |
Chemical Identifiers
| CAS Number | 476484-55-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC(=C(C=C4)Cl)Cl |
Product Overview
RefChem:448544 (CAS 476484-55-6), with molecular formula C23H17Cl3N4O2S and molecular weight 518.01 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4-dichlorophenyl)acetamide.
Chemical Property Profile of RefChem:448544
Property Insights of RefChem:448544
The XLogP value of 6.6339 indicates that RefChem:448544 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:448544. Following Lipinski's Rule of Five, RefChem:448544 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:448544?
The CAS number of RefChem:448544 is 476484-55-6.
What is the molecular formula of RefChem:448544?
The molecular formula of RefChem:448544 is C23H17Cl3N4O2S.
What is the molecular weight of RefChem:448544?
The molecular weight of RefChem:448544 is 518.01 g/mol.
Where can I buy RefChem:448544?
You can request a quote for RefChem:448544 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:448544?
Yes, KEHONG BIO provides custom synthesis services for RefChem:448544 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.