![2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide structure](/static/products/900/900873-63-4.png)
2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide
TL;DR: 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide (CAS 900873-63-4) is a chemical compound with molecular formula C18H17N5O2S2 and molecular weight 399.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-[3-(methylsulfanylmethyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]benzenesulfonamide
Also Known As: 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide, 2-methyl-5-[3-(methylsulfanylmethyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]benzenesulfonamide, 2-methyl-5-{3-[(methylsulfanyl)methyl][1,2,4]triazolo[3,4-a]phthalazin-6-yl}benzenesulfonamide
| Molecular Formula | C18H17N5O2S2 |
|---|---|
| Molecular Weight | 399.08 g/mol |
| LogP | 2.76332 |
| Topological Polar Surface Area | 103.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.08237 |
| Heavy Atoms | 27 |
| Complexity | 1281.8948 |
Chemical Identifiers
| CAS Number | 900873-63-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)CSC)S(=O)(=O)N |
Product Overview
2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide (CAS 900873-63-4), with molecular formula C18H17N5O2S2 and molecular weight 399.08 g/mol. IUPAC: 2-methyl-5-[3-(methylsulfanylmethyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl]benzenesulfonamide.
Chemical Property Profile of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide
Property Insights of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide
The XLogP value of 2.76332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide. The TPSA of 103.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide has 1 hydrogen bond donor(s) and 6 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 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide?
The CAS number of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide is 900873-63-4.
What is the molecular formula of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide?
The molecular formula of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide is C18H17N5O2S2.
What is the molecular weight of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide?
The molecular weight of 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide is 399.08 g/mol.
Where can I buy 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide?
You can request a quote for 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-5-(3-((methylthio)methyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.