3-Allyl-4-quinazolone
TL;DR: 3-Allyl-4-quinazolone (CAS 16347-55-0) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-prop-2-enylquinazolin-4-one
Also Known As: N3-allylquinazolin-4-one, 3-allyl-4-quinazolone, 3-prop-2-enylquinazolin-4-one, 3-Allylquinazolin-4(3H)-one, 3-Allyl-3,4-dihydroquinazoline-4-one
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 1.5825 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 528.0437 |
Chemical Identifiers
| CAS Number | 16347-55-0 |
|---|---|
| SMILES | C=CCN1C=NC2=CC=CC=C2C1=O |
Product Overview
3-Allyl-4-quinazolone (CAS 16347-55-0), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: 3-prop-2-enylquinazolin-4-one.
Chemical Property Profile of 3-Allyl-4-quinazolone
Property Insights of 3-Allyl-4-quinazolone
The XLogP value of 1.5825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Allyl-4-quinazolone. With a topological polar surface area (TPSA) of 34.89 Ų, 3-Allyl-4-quinazolone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Allyl-4-quinazolone has 0 hydrogen bond donor(s) and 2 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 3-Allyl-4-quinazolone?
The CAS number of 3-Allyl-4-quinazolone is 16347-55-0.
What is the molecular formula of 3-Allyl-4-quinazolone?
The molecular formula of 3-Allyl-4-quinazolone is C11H10N2O.
What is the molecular weight of 3-Allyl-4-quinazolone?
The molecular weight of 3-Allyl-4-quinazolone is 186.08 g/mol.
Where can I buy 3-Allyl-4-quinazolone?
You can request a quote for 3-Allyl-4-quinazolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Allyl-4-quinazolone?
Yes, KEHONG BIO provides custom synthesis services for 3-Allyl-4-quinazolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.