2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one
TL;DR: 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one (CAS 1003358-67-5) is a chemical compound with molecular formula C16H14N4O2 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dimethylpyrazol-1-yl)-3-prop-2-ynoxyquinazolin-4-one
Also Known As: 2-(3,5-dimethylpyrazol-1-yl)-3-prop-2-ynoxyquinazolin-4-one, 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one
| Molecular Formula | C16H14N4O2 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | 1.26084 |
| Topological Polar Surface Area | 61.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.11166 |
| Heavy Atoms | 22 |
| Complexity | 946.9147 |
Chemical Identifiers
| CAS Number | 1003358-67-5 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NC3=CC=CC=C3C(=O)N2OCC#C)C |
Product Overview
2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one (CAS 1003358-67-5), with molecular formula C16H14N4O2 and molecular weight 294.11 g/mol. IUPAC: 2-(3,5-dimethylpyrazol-1-yl)-3-prop-2-ynoxyquinazolin-4-one.
Chemical Property Profile of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one
Property Insights of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one
The XLogP value of 1.26084 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one. The TPSA of 61.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one. Following Lipinski's Rule of Five, 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 4 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)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one?
The CAS number of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one is 1003358-67-5.
What is the molecular formula of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one?
The molecular formula of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one is C16H14N4O2.
What is the molecular weight of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one?
The molecular weight of 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one is 294.11 g/mol.
Where can I buy 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one?
You can request a quote for 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one 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)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(prop-2-yn-1-yloxy)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.