3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one
TL;DR: 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one (CAS 674294-70-3) is a chemical compound with molecular formula C9H8N2O2S and molecular weight 208.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 3-methoxy-2-sulfanylidene-1H-quinazolin-4-one, 3-methoxy-2-sulfanylquinazolin-4(3H)-one, 3-methoxy-2-thioxo-1,3-dihydroquinazolin-4-one, 3-methoxy-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
| Molecular Formula | C9H8N2O2S |
|---|---|
| Molecular Weight | 208.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.03065 |
| Heavy Atoms | 14 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 674294-70-3 |
|---|---|
| SMILES | CON1C(=O)C2=CC=CC=C2NC1=S |
| InChIKey | SPDNAWBEGDGDQJ-UHFFFAOYSA-N |
Product Overview
3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one (CAS 674294-70-3), with molecular formula C9H8N2O2S and molecular weight 208.03 g/mol. IUPAC: 3-methoxy-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one
Property Insights of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one. Following Lipinski's Rule of Five, 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-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-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one?
The CAS number of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one is 674294-70-3.
What is the molecular formula of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one?
The molecular formula of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one is C9H8N2O2S.
What is the molecular weight of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one?
The molecular weight of 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one is 208.03 g/mol.
Where can I buy 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one?
You can request a quote for 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-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-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-2-thioxo-1,3-dihydroquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.