2,3,6-Trimethylquinazolin-4-one
TL;DR: 2,3,6-Trimethylquinazolin-4-one (CAS 63190-58-9) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,6-trimethylquinazolin-4-one
Also Known As: 2,3,6-trimethylquinazolin-4-one, 2,3,6-Trimethylquinazolin-4(3H)-one, 2,3,6-trimethyl-3,4-dihydroquinazolin-4-one
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 63190-58-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(N(C2=O)C)C |
| InChIKey | BMWFOQLEZCMJPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,6-Trimethylquinazolin-4-one (CAS 63190-58-9), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 2,3,6-trimethylquinazolin-4-one.
Chemical Property Profile of 2,3,6-Trimethylquinazolin-4-one
Property Insights of 2,3,6-Trimethylquinazolin-4-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,6-Trimethylquinazolin-4-one. With a topological polar surface area (TPSA) of 32.7 Ų, 2,3,6-Trimethylquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,6-Trimethylquinazolin-4-one 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 2,3,6-Trimethylquinazolin-4-one?
The CAS number of 2,3,6-Trimethylquinazolin-4-one is 63190-58-9.
What is the molecular formula of 2,3,6-Trimethylquinazolin-4-one?
The molecular formula of 2,3,6-Trimethylquinazolin-4-one is C11H12N2O.
What is the molecular weight of 2,3,6-Trimethylquinazolin-4-one?
The molecular weight of 2,3,6-Trimethylquinazolin-4-one is 188.09 g/mol.
Where can I buy 2,3,6-Trimethylquinazolin-4-one?
You can request a quote for 2,3,6-Trimethylquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,6-Trimethylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3,6-Trimethylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.