![2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide structure](/static/products/4970/497083-41-7.webp)
2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide
TL;DR: 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide (CAS 497083-41-7) is a chemical compound with molecular formula C25H22BrN5O2S and molecular weight 535.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(3-methoxyphenyl)ethylideneamino]acetamide
Also Known As: 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide, 2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(3-methoxyphenyl)ethylideneamino]acetamide, Acetic acid, 2-[[4-(4-bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[1-(3-methoxyphenyl)ethylidene]hydrazide
| Molecular Formula | C25H22BrN5O2S |
|---|---|
| Molecular Weight | 535.07 g/mol |
| LogP | 5.3379 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.06775 |
| Heavy Atoms | 34 |
| Complexity | 1306.6527 |
Chemical Identifiers
| CAS Number | 497083-41-7 |
|---|---|
| SMILES | CC(=NNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CC=CC=C3)C4=CC(=CC=C4)OC |
Product Overview
2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide (CAS 497083-41-7), with molecular formula C25H22BrN5O2S and molecular weight 535.07 g/mol. IUPAC: 2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(3-methoxyphenyl)ethylideneamino]acetamide.
Chemical Property Profile of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide
Property Insights of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide
The XLogP value of 5.3379 indicates that 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide. Following Lipinski's Rule of Five, 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide 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 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide?
The CAS number of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide is 497083-41-7.
What is the molecular formula of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide?
The molecular formula of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide is C25H22BrN5O2S.
What is the molecular weight of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide?
The molecular weight of 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide is 535.07 g/mol.
Where can I buy 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide?
You can request a quote for 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[4-(4-Bromophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]acetic acid 2-[1-(3-methoxyphenyl)ethylidene]hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.