1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone
TL;DR: 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone (CAS 1083197-44-7) is a chemical compound with molecular formula C16H12N2O3S and molecular weight 312.05685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dihydroxyphenyl)-2-quinazolin-4-ylsulfanylethanone
Also Known As: 1-(3,4-dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone, 1-(3,4-dihydroxyphenyl)-2-quinazolin-4-ylthioethan-1-one
Technical Specifications
| Molecular Formula | C16H12N2O3S |
| Molecular Weight | 312.05685 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.05685 Da |
| Heavy Atoms | 22 |
| Complexity | 396.0 |
| SMILES | C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)C3=CC(=C(C=C3)O)O |
| InChIKey | SVOGZOKLUCXZST-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone
Property Insights of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone
The XLogP value of 3.1 indicates that 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone. Following Lipinski's Rule of Five, 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone?
The CAS number of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone is 1083197-44-7.
What is the molecular formula of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone?
The molecular formula of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone is C16H12N2O3S.
What is the molecular weight of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone?
The molecular weight of 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone is 312.05685 g/mol.
Where can I buy 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone?
You can request a quote for 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(3,4-Dihydroxyphenyl)-2-(quinazolin-4-ylsulfanyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.