![5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine structure](/static/products/827/827006-54-2.png)
5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
TL;DR: 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (CAS 827006-54-2) is a chemical compound with molecular formula C14H14N6O2 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-N-[(3-nitrophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Also Known As: CBKinase1_009820, CBKinase1_022220, BRD-K03972234-001-01-8, 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine, 5,7-dimethyl-N-(3-nitrobenzyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
| Molecular Formula | C14H14N6O2 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 2.26144 |
| Topological Polar Surface Area | 98.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.11783 |
| Heavy Atoms | 22 |
| Complexity | 857.6604 |
Chemical Identifiers
| CAS Number | 827006-54-2 |
|---|---|
| SMILES | CC1=CC(=NC2=NC(=NN12)NCC3=CC(=CC=C3)[N+](=O)[O-])C |
Product Overview
5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine (CAS 827006-54-2), with molecular formula C14H14N6O2 and molecular weight 298.12 g/mol. IUPAC: 5,7-dimethyl-N-[(3-nitrophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine.
Chemical Property Profile of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Property Insights of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
The XLogP value of 2.26144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine. The TPSA of 98.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine. Following Lipinski's Rule of Five, 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine has 1 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 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The CAS number of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is 827006-54-2.
What is the molecular formula of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The molecular formula of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is C14H14N6O2.
What is the molecular weight of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
The molecular weight of 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine is 298.12 g/mol.
Where can I buy 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
You can request a quote for 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 5,7-dimethyl-N-(3-nitrobenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.