RefChem:819933
TL;DR: RefChem:819933 (CAS 477734-73-9) is a chemical compound with molecular formula C22H21Br2N5OS and molecular weight 560.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(4-bromophenyl)ethylideneamino]-2-[[5-(4-bromophenyl)-4-(2-methylprop-2-enyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N'-[(E)-1-(4-BROMOPHENYL)ETHYLIDENE]-2-{[5-(4-BROMOPHENYL)-4-(2-METHYL-2-PROPENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETOHYDRAZIDE, 651-121-6, N'-((E)-1-(4-Bromophenyl)ethylidene)-2-((5-(4-bromophenyl)-4-(2-methyl-2-propenyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetohydrazide, N-[(1E)-2-(4-bromophenyl)-1-azaprop-1-enyl]-2-[5-(4-bromophenyl)-4-(2-methylpr op-2-enyl)(1,2,4-triazol-3-ylthio)]acetamide, N-[(E)-1-(4-bromophenyl)ethylideneamino]-2-[[5-(4-bromophenyl)-4-(2-methylprop-2-enyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H21Br2N5OS |
|---|---|
| Molecular Weight | 560.98 g/mol |
| LogP | 5.6787 |
| Topological Polar Surface Area | 72.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 560.98334 |
| Heavy Atoms | 31 |
| Complexity | 1107.9348 |
Chemical Identifiers
| CAS Number | 477734-73-9 |
|---|---|
| SMILES | CC(=C)CN1C(=NN=C1SCC(=O)N/N=C(\C)/C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br |
Product Overview
RefChem:819933 (CAS 477734-73-9), with molecular formula C22H21Br2N5OS and molecular weight 560.98 g/mol. IUPAC: N-[(E)-1-(4-bromophenyl)ethylideneamino]-2-[[5-(4-bromophenyl)-4-(2-methylprop-2-enyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of RefChem:819933
Property Insights of RefChem:819933
The XLogP value of 5.6787 indicates that RefChem:819933 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.17 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:819933. Following Lipinski's Rule of Five, RefChem:819933 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:819933?
The CAS number of RefChem:819933 is 477734-73-9.
What is the molecular formula of RefChem:819933?
The molecular formula of RefChem:819933 is C22H21Br2N5OS.
What is the molecular weight of RefChem:819933?
The molecular weight of RefChem:819933 is 560.98 g/mol.
Where can I buy RefChem:819933?
You can request a quote for RefChem:819933 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:819933?
Yes, KEHONG BIO provides custom synthesis services for RefChem:819933 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.