![3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine structure](/static/products/558/55898-89-0.png)
3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine
TL;DR: 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine (CAS 55898-89-0) is a chemical compound with molecular formula C12H12N6 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine
Also Known As: 9-benzyl-2-methyl-8-azaadenine, ASN 06745005, 3-benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine, 3-Benzyl-5-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamine
| Molecular Formula | C12H12N6 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 1.16022 |
| Topological Polar Surface Area | 82.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.11235 |
| Heavy Atoms | 18 |
| Complexity | 688.3591 |
Chemical Identifiers
| CAS Number | 55898-89-0 |
|---|---|
| SMILES | CC1=NC(=C2C(=N1)N(N=N2)CC3=CC=CC=C3)N |
Product Overview
3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine (CAS 55898-89-0), with molecular formula C12H12N6 and molecular weight 240.11 g/mol. IUPAC: 3-benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine.
Chemical Property Profile of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine
Property Insights of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine
The XLogP value of 1.16022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine. The TPSA of 82.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine. Following Lipinski's Rule of Five, 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine has 1 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 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine?
The CAS number of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine is 55898-89-0.
What is the molecular formula of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine?
The molecular formula of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine is C12H12N6.
What is the molecular weight of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine?
The molecular weight of 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine is 240.11 g/mol.
Where can I buy 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine?
You can request a quote for 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.