RefChem:449360
TL;DR: RefChem:449360 (CAS 538337-70-1) is a chemical compound with molecular formula C26H24Cl2N4O2S and molecular weight 526.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide
Also Known As: 2-({5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethylphenyl)acetamide, 2-((5-((2,4-Dichlorophenoxy)methyl)-4-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,5-dimethylphenyl)acetamide, 2-{[5-[(2,4-DICHLOROPHENOXY)METHYL]-4-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-N-(2,5-DIMETHYLPHENYL)ACETAMIDE, 2-((5-((2,4-Dichlorophenoxy)methyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-YL)sulfanyl)-N-(2,5-dimethylphenyl)acetamide, 2-[[5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide
| Molecular Formula | C26H24Cl2N4O2S |
|---|---|
| Molecular Weight | 526.10 g/mol |
| LogP | 6.80916 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 526.09973 |
| Heavy Atoms | 35 |
| Complexity | 1373.4716 |
Chemical Identifiers
| CAS Number | 538337-70-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3C)COC4=C(C=C(C=C4)Cl)Cl |
Product Overview
RefChem:449360 (CAS 538337-70-1), with molecular formula C26H24Cl2N4O2S and molecular weight 526.10 g/mol. IUPAC: 2-[[5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide.
Chemical Property Profile of RefChem:449360
Property Insights of RefChem:449360
The XLogP value of 6.80916 indicates that RefChem:449360 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:449360. Following Lipinski's Rule of Five, RefChem:449360 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:449360?
The CAS number of RefChem:449360 is 538337-70-1.
What is the molecular formula of RefChem:449360?
The molecular formula of RefChem:449360 is C26H24Cl2N4O2S.
What is the molecular weight of RefChem:449360?
The molecular weight of RefChem:449360 is 526.10 g/mol.
Where can I buy RefChem:449360?
You can request a quote for RefChem:449360 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:449360?
Yes, KEHONG BIO provides custom synthesis services for RefChem:449360 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.