RefChem:824120
TL;DR: RefChem:824120 (CAS 539808-63-4) is a chemical compound with molecular formula C24H20Cl2N4O3S and molecular weight 514.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dichlorophenyl)-2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(2,6-dichlorophenyl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 644-726-1, N-(2,6-DICHLOROPHENYL)-2-((4-(4-METHOXYPHENYL)-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)ACETAMIDE, N-(2,6-Dichlorophenyl)-2-((4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2,6-dichlorophenyl)-2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C24H20Cl2N4O3S |
|---|---|
| Molecular Weight | 514.06 g/mol |
| LogP | 5.8925 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 514.0633 |
| Heavy Atoms | 34 |
| Complexity | 1246.9656 |
Chemical Identifiers
| CAS Number | 539808-63-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC=C3Cl)Cl)COC4=CC=CC=C4 |
Product Overview
RefChem:824120 (CAS 539808-63-4), with molecular formula C24H20Cl2N4O3S and molecular weight 514.06 g/mol. IUPAC: N-(2,6-dichlorophenyl)-2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of RefChem:824120
Property Insights of RefChem:824120
The XLogP value of 5.8925 indicates that RefChem:824120 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:824120. Following Lipinski's Rule of Five, RefChem:824120 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:824120?
The CAS number of RefChem:824120 is 539808-63-4.
What is the molecular formula of RefChem:824120?
The molecular formula of RefChem:824120 is C24H20Cl2N4O3S.
What is the molecular weight of RefChem:824120?
The molecular weight of RefChem:824120 is 514.06 g/mol.
Where can I buy RefChem:824120?
You can request a quote for RefChem:824120 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:824120?
Yes, KEHONG BIO provides custom synthesis services for RefChem:824120 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.