3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one
TL;DR: 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one (CAS 6437-06-5) is a chemical compound with molecular formula C10H10N2OS and molecular weight 206.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-methylsulfanylquinazolin-4-one
Also Known As: Maybridge4_002964, 3-methyl-2-methylthio-4-quinazolone, BAS 03710728, 3-methyl-2-(methylthio)quinazolin-4(3H)-one, 3-methyl-2-methylsulfanylquinazolin-4-one
| Molecular Formula | C10H10N2OS |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.05139 |
| Heavy Atoms | 14 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 6437-06-5 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2N=C1SC |
| InChIKey | IMNUDUZCMFTLBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one (CAS 6437-06-5), with molecular formula C10H10N2OS and molecular weight 206.05 g/mol. IUPAC: 3-methyl-2-methylsulfanylquinazolin-4-one.
Chemical Property Profile of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one
Property Insights of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one. With a topological polar surface area (TPSA) of 58.0 Ų, 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one has 0 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-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one?
The CAS number of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one is 6437-06-5.
What is the molecular formula of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one?
The molecular formula of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one is C10H10N2OS.
What is the molecular weight of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one?
The molecular weight of 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one is 206.05 g/mol.
Where can I buy 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one?
You can request a quote for 3-methyl-2-(methylsulfanyl)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 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-2-(methylsulfanyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.