RefChem:830187
TL;DR: RefChem:830187 (CAS 539809-62-6) is a chemical compound with molecular formula C29H32N4O2S and molecular weight 500.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-ylacetamide
Also Known As: A3057/0129153, N-ISOPROPYL-N-PHENYL-2-({4-PHENYL-5-[(4-PROPYLPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)ACETAMIDE, N-Isopropyl-N-phenyl-2-((4-phenyl-5-((4-propylphenoxy)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 644-646-7, N-Isopropyl-N-phenyl-2-((4-phenyl-5-((4-propylphenoxy)methyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetamide
| Molecular Formula | C29H32N4O2S |
|---|---|
| Molecular Weight | 500.22 g/mol |
| LogP | 6.3325 |
| Topological Polar Surface Area | 60.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 500.2246 |
| Heavy Atoms | 36 |
| Complexity | 1241.5314 |
Chemical Identifiers
| CAS Number | 539809-62-6 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N(C4=CC=CC=C4)C(C)C |
Product Overview
RefChem:830187 (CAS 539809-62-6), with molecular formula C29H32N4O2S and molecular weight 500.22 g/mol. IUPAC: N-phenyl-2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-ylacetamide.
Chemical Property Profile of RefChem:830187
Property Insights of RefChem:830187
The XLogP value of 6.3325 indicates that RefChem:830187 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.25 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:830187. Following Lipinski's Rule of Five, RefChem:830187 has 0 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:830187?
The CAS number of RefChem:830187 is 539809-62-6.
What is the molecular formula of RefChem:830187?
The molecular formula of RefChem:830187 is C29H32N4O2S.
What is the molecular weight of RefChem:830187?
The molecular weight of RefChem:830187 is 500.22 g/mol.
Where can I buy RefChem:830187?
You can request a quote for RefChem:830187 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:830187?
Yes, KEHONG BIO provides custom synthesis services for RefChem:830187 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.