![2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one structure](/static/products/879/879603-85-7.png)
2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
TL;DR: 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 879603-85-7) is a chemical compound with molecular formula C11H16N4O and molecular weight 220.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-2-(2-methylpropyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
Also Known As: 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one, 5,6-dimethyl-2-(2-methylpropyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol, 5,6-dimethyl-2-(2-methylpropyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one, 5,6-dimethyl-2-(2-methylpropyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
| Molecular Formula | C11H16N4O |
|---|---|
| Molecular Weight | 220.13 g/mol |
| LogP | 1.23294 |
| Topological Polar Surface Area | 63.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.13242 |
| Heavy Atoms | 16 |
| Complexity | 579.4175 |
Chemical Identifiers
| CAS Number | 879603-85-7 |
|---|---|
| SMILES | CC1=C(N=C2N=C(NN2C1=O)CC(C)C)C |
Product Overview
2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 879603-85-7), with molecular formula C11H16N4O and molecular weight 220.13 g/mol. IUPAC: 5,6-dimethyl-2-(2-methylpropyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.
Chemical Property Profile of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Property Insights of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
The XLogP value of 1.23294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one. The TPSA of 63.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one. Following Lipinski's Rule of Five, 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one has 1 hydrogen bond donor(s) and 3 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 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
The CAS number of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one is 879603-85-7.
What is the molecular formula of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular formula of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one is C11H16N4O.
What is the molecular weight of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular weight of 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one is 220.13 g/mol.
Where can I buy 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
You can request a quote for 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-isobutyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.