3-hydroxy-2-methylquinazolin-4(3H)-one
TL;DR: 3-hydroxy-2-methylquinazolin-4(3H)-one (CAS 54518-07-9) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-methylquinazolin-4-one
Also Known As: 3-hydroxy-2-methylquinazolin-4(3H)-one, 3-hydroxy-2-methylquinazolin-4-one, starbld0034398, 3-hydroxy-2-methyl-3,4-dihydroquinazolin-4-one, 2-Methylquinazolin-4-ol 3-oxide
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 54518-07-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1O |
| InChIKey | SVWRTXYWBOQPGD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-hydroxy-2-methylquinazolin-4(3H)-one (CAS 54518-07-9), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 3-hydroxy-2-methylquinazolin-4-one.
Chemical Property Profile of 3-hydroxy-2-methylquinazolin-4(3H)-one
Property Insights of 3-hydroxy-2-methylquinazolin-4(3H)-one
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-hydroxy-2-methylquinazolin-4(3H)-one. With a topological polar surface area (TPSA) of 52.9 Ų, 3-hydroxy-2-methylquinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-hydroxy-2-methylquinazolin-4(3H)-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 3-hydroxy-2-methylquinazolin-4(3H)-one?
The CAS number of 3-hydroxy-2-methylquinazolin-4(3H)-one is 54518-07-9.
What is the molecular formula of 3-hydroxy-2-methylquinazolin-4(3H)-one?
The molecular formula of 3-hydroxy-2-methylquinazolin-4(3H)-one is C9H8N2O2.
What is the molecular weight of 3-hydroxy-2-methylquinazolin-4(3H)-one?
The molecular weight of 3-hydroxy-2-methylquinazolin-4(3H)-one is 176.06 g/mol.
Where can I buy 3-hydroxy-2-methylquinazolin-4(3H)-one?
You can request a quote for 3-hydroxy-2-methylquinazolin-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 3-hydroxy-2-methylquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-hydroxy-2-methylquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.