![1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE structure](/static/products/487/487024-60-2.png)
1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE
TL;DR: 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE (CAS 487024-60-2) is a chemical compound with molecular formula C15H11N7S2 and molecular weight 353.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(10-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl)methylsulfanyl]-1,3-benzothiazole
Also Known As: 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE, 2-(((7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl)thio)benzo[d]thiazole, 2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C15H11N7S2 |
|---|---|
| Molecular Weight | 353.05 g/mol |
| LogP | 2.913 |
| Topological Polar Surface Area | 73.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.05173 |
| Heavy Atoms | 24 |
| Complexity | 1153.6503 |
Chemical Identifiers
| CAS Number | 487024-60-2 |
|---|---|
| SMILES | CN1C2=C(C=N1)C3=NC(=NN3C=N2)CSC4=NC5=CC=CC=C5S4 |
Product Overview
1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE (CAS 487024-60-2), with molecular formula C15H11N7S2 and molecular weight 353.05 g/mol. IUPAC: 2-[(10-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl)methylsulfanyl]-1,3-benzothiazole.
Chemical Property Profile of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE
Property Insights of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE
The XLogP value of 2.913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE. The TPSA of 73.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE. Following Lipinski's Rule of Five, 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE has 0 hydrogen bond donor(s) and 7 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 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE?
The CAS number of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE is 487024-60-2.
What is the molecular formula of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE?
The molecular formula of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE is C15H11N7S2.
What is the molecular weight of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE?
The molecular weight of 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE is 353.05 g/mol.
Where can I buy 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE?
You can request a quote for 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE?
Yes, KEHONG BIO provides custom synthesis services for 1,3-BENZOTHIAZOL-2-YL [(7-METHYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL] SULFIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.