3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one
TL;DR: 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one (CAS 914357-21-4) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one
Also Known As: 3-methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one, 3-methyl-2-[(2-oxopropyl)sulfanyl]-4(3H)-quinazolinone, AP-853/43386875, 3-methyl-2-[(2-oxopropyl)sulfanyl]quinazolin-4(3H)-one
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | 1.6146 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 633.9285 |
Chemical Identifiers
| CAS Number | 914357-21-4 |
|---|---|
| SMILES | CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C |
Product Overview
3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one (CAS 914357-21-4), with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol. IUPAC: 3-methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one.
Chemical Property Profile of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one
Property Insights of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one
The XLogP value of 1.6146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one. With a topological polar surface area (TPSA) of 51.96 Ų, 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-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 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one?
The CAS number of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one is 914357-21-4.
What is the molecular formula of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one?
The molecular formula of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one is C12H12N2O2S.
What is the molecular weight of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one?
The molecular weight of 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one is 248.06 g/mol.
Where can I buy 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one?
You can request a quote for 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-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-(2-oxopropylsulfanyl)quinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-(2-oxopropylsulfanyl)quinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.