N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
TL;DR: N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine (CAS 896367-93-4) is a chemical compound with molecular formula C8H10N6 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-prop-2-enyltriazolo[4,5-d]pyrimidin-7-amine
Also Known As: N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine, 3-methyl-N-prop-2-enyltriazolo[4,5-d]pyrimidin-7-amine, 3-methyl-N-(prop-2-en-1-yl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine, F2792-0065, 3-methyl-N-(prop-2-en-1-yl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
| Molecular Formula | C8H10N6 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 0.3562 |
| Topological Polar Surface Area | 68.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.0967 |
| Heavy Atoms | 14 |
| Complexity | 459.7995 |
Chemical Identifiers
| CAS Number | 896367-93-4 |
|---|---|
| SMILES | CN1C2=NC=NC(=C2N=N1)NCC=C |
Product Overview
N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine (CAS 896367-93-4), with molecular formula C8H10N6 and molecular weight 190.10 g/mol. IUPAC: 3-methyl-N-prop-2-enyltriazolo[4,5-d]pyrimidin-7-amine.
Chemical Property Profile of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Property Insights of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
The XLogP value of 0.3562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine. The TPSA of 68.52 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine. Following Lipinski's Rule of Five, N-allyl-3-methyl-3H-[1,2,3]triazolo[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 N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine?
The CAS number of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine is 896367-93-4.
What is the molecular formula of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine?
The molecular formula of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine is C8H10N6.
What is the molecular weight of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine?
The molecular weight of N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine is 190.10 g/mol.
Where can I buy N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine?
You can request a quote for N-allyl-3-methyl-3H-[1,2,3]triazolo[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 N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.