![1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine structure](/static/products/470/470441-68-0.png)
1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine
TL;DR: 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine (CAS 470441-68-0) is a chemical compound with molecular formula C16H19N7 and molecular weight 309.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-benzylpiperazin-1-yl)-3-methyltriazolo[4,5-d]pyrimidine
Also Known As: 7-(4-benzylpiperazin-1-yl)-3-methyltriazolo[4,5-d]pyrimidine, 1-BENZYL-4-{3-METHYL-3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-7-YL}PIPERAZINE, 7-(4-benzylpiperazin-1-yl)-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine, 3-Methyl-7-[4-(phenylmethyl)-1-piperazinyl]-3H-1,2,3-triazolo[4,5-d]pyrimidine, 2-(4-benzylpiperazin-1-yl)-7-methyl-3,5,7,8,9-pentazabicyclo[4.3.0]nona-2,4,8,10-tetraene
| Molecular Formula | C16H19N7 |
|---|---|
| Molecular Weight | 309.17 g/mol |
| LogP | 1.0805 |
| Topological Polar Surface Area | 62.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.1702 |
| Heavy Atoms | 23 |
| Complexity | 790.5538 |
Chemical Identifiers
| CAS Number | 470441-68-0 |
|---|---|
| SMILES | CN1C2=C(C(=NC=N2)N3CCN(CC3)CC4=CC=CC=C4)N=N1 |
Product Overview
1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine (CAS 470441-68-0), with molecular formula C16H19N7 and molecular weight 309.17 g/mol. IUPAC: 7-(4-benzylpiperazin-1-yl)-3-methyltriazolo[4,5-d]pyrimidine.
Chemical Property Profile of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine
Property Insights of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine
The XLogP value of 1.0805 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine. The TPSA of 62.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine. Following Lipinski's Rule of Five, 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine has 0 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 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine?
The CAS number of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine is 470441-68-0.
What is the molecular formula of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine?
The molecular formula of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine is C16H19N7.
What is the molecular weight of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine?
The molecular weight of 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine is 309.17 g/mol.
Where can I buy 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine?
You can request a quote for 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-4-{3-methyl-3H-[1,2,3]triazolo[4,5-D]pyrimidin-7-YL}piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.