3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
TL;DR: 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one (CAS 155270-69-2) is a chemical compound with molecular formula C14H9FN2OS and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 3-(4-fluorophenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one, 3-(4-fluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one, 3-(4-Fluorophenyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone, 3-(4-fluoro-phenyl)-2-mercapto-3h-quinazolin-4-one, 3-(4-Fluoro-phenyl)-2-thioxo-2,3-dihydro-1H-quinazolin-4-one
| Molecular Formula | C14H9FN2OS |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.04196 |
| Heavy Atoms | 19 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 155270-69-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)F |
| InChIKey | IQKUFJBAPHQXBC-UHFFFAOYSA-N |
Product Overview
3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one (CAS 155270-69-2), with molecular formula C14H9FN2OS and molecular weight 272.04 g/mol. IUPAC: 3-(4-fluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Property Insights of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one. Following Lipinski's Rule of Five, 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-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-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one?
The CAS number of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one is 155270-69-2.
What is the molecular formula of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one?
The molecular formula of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one is C14H9FN2OS.
What is the molecular weight of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one?
The molecular weight of 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one is 272.04 g/mol.
Where can I buy 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one?
You can request a quote for 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorophenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.