![{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile structure](/static/products/850/850746-69-9.png)
{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile
TL;DR: {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile (CAS 850746-69-9) is a chemical compound with molecular formula C15H13N5O2 and molecular weight 295.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,5-dimethylpyrazol-1-yl)-4-oxoquinazolin-3-yl]oxyacetonitrile
Also Known As: BRD-K79973568-001-10-2, 2-[2-(3,5-dimethylpyrazol-1-yl)-4-oxoquinazolin-3-yl]oxyacetonitrile, {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile, 2-((2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl)oxy)acetonitrile
| Molecular Formula | C15H13N5O2 |
|---|---|
| Molecular Weight | 295.11 g/mol |
| LogP | 1.15122 |
| Topological Polar Surface Area | 85.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.10693 |
| Heavy Atoms | 22 |
| Complexity | 948.7017 |
Chemical Identifiers
| CAS Number | 850746-69-9 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NC3=CC=CC=C3C(=O)N2OCC#N)C |
Product Overview
{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile (CAS 850746-69-9), with molecular formula C15H13N5O2 and molecular weight 295.11 g/mol. IUPAC: 2-[2-(3,5-dimethylpyrazol-1-yl)-4-oxoquinazolin-3-yl]oxyacetonitrile.
Chemical Property Profile of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile
Property Insights of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile
The XLogP value of 1.15122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile. The TPSA of 85.73 Ų falls within the moderate polarity range, balancing permeability and solubility for {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile. Following Lipinski's Rule of Five, {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile has 0 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 {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile?
The CAS number of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile is 850746-69-9.
What is the molecular formula of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile?
The molecular formula of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile is C15H13N5O2.
What is the molecular weight of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile?
The molecular weight of {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile is 295.11 g/mol.
Where can I buy {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile?
You can request a quote for {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for {[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxoquinazolin-3(4H)-yl]oxy}acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.