![3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine structure](/static/products/7241/72411-39-3.webp)
3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine
TL;DR: 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine (CAS 72411-39-3) is a chemical compound with molecular formula C9H10N6 and molecular weight 202.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7,11-trimethyl-1,3,4,6,10,12-hexazatricyclo[7.3.0.02,6]dodeca-2,4,7,9,11-pentaene
Also Known As: 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine, 3,5,8-Trimethylbis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine, 5,7,11-Trimethyl-1,3,4,6,10,12-hexazatricyclo[7.3.0.02,6]dodeca-2,4,7,9,11-pentaene
| Molecular Formula | C9H10N6 |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 202.0967 |
| Heavy Atoms | 15 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 72411-39-3 |
|---|---|
| SMILES | CC1=CC2=NC(=NN2C3=NN=C(N13)C)C |
| InChIKey | UZHWMSMMYAHRDO-UHFFFAOYSA-N |
Product Overview
3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine (CAS 72411-39-3), with molecular formula C9H10N6 and molecular weight 202.10 g/mol. IUPAC: 5,7,11-trimethyl-1,3,4,6,10,12-hexazatricyclo[7.3.0.02,6]dodeca-2,4,7,9,11-pentaene.
Chemical Property Profile of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine
Property Insights of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine. Following Lipinski's Rule of Five, 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine has 0 hydrogen bond donor(s) and 4 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 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine?
The CAS number of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine is 72411-39-3.
What is the molecular formula of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine?
The molecular formula of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine is C9H10N6.
What is the molecular weight of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine?
The molecular weight of 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine is 202.10 g/mol.
Where can I buy 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine?
You can request a quote for 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 3,5,8-trimethyldi[1,2,4]triazolo[1,4-b:1',4'-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.