RefChem:448884
TL;DR: RefChem:448884 (CAS 538337-10-9) is a chemical compound with molecular formula C24H19BrCl2N4O2S and molecular weight 575.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-benzyl-5-[(4-bromophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dichlorophenyl)acetamide
Also Known As: 2-({4-benzyl-5-[(4-bromophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dichlorophenyl)acetamide, 2-((4-Benzyl-5-((4-bromophenoxy)methyl)-4H-1,2,4-triazol-3-YL)sulfanyl)-N-(2,5-dichlorophenyl)acetamide, 2-((4-Benzyl-5-((4-bromophenoxy)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,5-dichlorophenyl)acetamide, 2-[[4-benzyl-5-[(4-bromophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dichlorophenyl)acetamide, 644-874-7
| Molecular Formula | C24H19BrCl2N4O2S |
|---|---|
| Molecular Weight | 575.98 g/mol |
| LogP | 6.7055 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 575.9789 |
| Heavy Atoms | 34 |
| Complexity | 1269.9705 |
Chemical Identifiers
| CAS Number | 538337-10-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)Cl)Cl)COC4=CC=C(C=C4)Br |
Product Overview
RefChem:448884 (CAS 538337-10-9), with molecular formula C24H19BrCl2N4O2S and molecular weight 575.98 g/mol. IUPAC: 2-[[4-benzyl-5-[(4-bromophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dichlorophenyl)acetamide.
Chemical Property Profile of RefChem:448884
Property Insights of RefChem:448884
The XLogP value of 6.7055 indicates that RefChem:448884 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:448884. Following Lipinski's Rule of Five, RefChem:448884 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:448884?
The CAS number of RefChem:448884 is 538337-10-9.
What is the molecular formula of RefChem:448884?
The molecular formula of RefChem:448884 is C24H19BrCl2N4O2S.
What is the molecular weight of RefChem:448884?
The molecular weight of RefChem:448884 is 575.98 g/mol.
Where can I buy RefChem:448884?
You can request a quote for RefChem:448884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:448884?
Yes, KEHONG BIO provides custom synthesis services for RefChem:448884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.