6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione
TL;DR: 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione (CAS 303094-65-7) is a chemical compound with molecular formula C16H10Br2N4O2S and molecular weight 479.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-[(3,5-dibromo-2-hydroxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one
Also Known As: 6-(2-((3,5-DI-BR-2-HYDROXYBENZYLIDENE)AMINO)PH)-5-HO-1,2,4-TRIAZINE-3(4H)-THIONE, 6-(2-((3,5-Dibromo-2-hydroxybenzylidene)amino)phenyl)-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one, 6-[2-[(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one, 6-{2-[(1E)-2-(3,5-dibromo-2-hydroxyphenyl)-1-azavinyl]phenyl}-3-thioxo-2H,4H-1 ,2,4-triazin-5-one, 683-978-7
| Molecular Formula | C16H10Br2N4O2S |
|---|---|
| Molecular Weight | 479.89 g/mol |
| LogP | 4.47569 |
| Topological Polar Surface Area | 94.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 479.88913 |
| Heavy Atoms | 25 |
| Complexity | 1091.9781 |
Chemical Identifiers
| CAS Number | 303094-65-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NNC(=S)NC2=O)N=CC3=C(C(=CC(=C3)Br)Br)O |
Product Overview
6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione (CAS 303094-65-7), with molecular formula C16H10Br2N4O2S and molecular weight 479.89 g/mol. IUPAC: 6-[2-[(3,5-dibromo-2-hydroxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one.
Chemical Property Profile of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione
Property Insights of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione
The XLogP value of 4.47569 indicates that 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione. Following Lipinski's Rule of Five, 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione?
The CAS number of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione is 303094-65-7.
What is the molecular formula of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione?
The molecular formula of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione is C16H10Br2N4O2S.
What is the molecular weight of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione?
The molecular weight of 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione is 479.89 g/mol.
Where can I buy 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione?
You can request a quote for 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-((3,5-DI-BR-2-Hydroxybenzylidene)amino)PH)-5-HO-1,2,4-triazine-3(4H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.