6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline

C14H8F2N2S — CID 133429642

IUPAC6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline
SMILESFc1cccc(Sc2ncnc3ccc(F)cc23)c1
InChIInChI=1S/C14H8F2N2S/c15-9-2-1-3-11(6-9)19-14-12-7-10(16)4-5-13(12)17-8-18-14/h1-8H
InChIKeyRHXWXARTGWHFFB-UHFFFAOYSA-N
MW274.30 g/mol
LogP4.06
Rot. Bonds2

About 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline

6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline (PubChem CID 133429642) has the molecular formula C14H8F2N2S and a molecular weight of 274.30 g/mol. Its IUPAC name is 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline.

Molecular Properties

Compound Name6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline
PubChem CID133429642
Molecular FormulaC14H8F2N2S
Molecular Weight274.30 g/mol
Exact Mass274.04
IUPAC Name6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline
SMILESFc1cccc(Sc2ncnc3ccc(F)cc23)c1
InChIInChI=1S/C14H8F2N2S/c15-9-2-1-3-11(6-9)19-14-12-7-10(16)4-5-13(12)17-8-18-14/h1-8H
InChIKeyRHXWXARTGWHFFB-UHFFFAOYSA-N
XLogP4.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-fluoro-4-pyridin-4-ylsulfanylquinazoline
CID 130258037
6-fluoro-4-(2-fluorophenyl)sulfanylquinazoline
CID 133424999
4-(4-fluorophenyl)sulfanylquinazolin-6-amine
CID 64588532
3-fluoro-5-quinazolin-4-ylsulfanylaniline
CID 60894924
3-(6-methylquinazolin-4-yl)sulfanylbenzonitrile
CID 133430096
6-(3-fluorophenyl)sulfanyl-5-propan-2-ylpyrimidin-4-amine
CID 80894171
4-cyclopentylsulfanyl-6-fluoroquinazoline
CID 129024670
4-cyclohexylsulfanyl-6-fluoroquinazoline
CID 129024661
2-(6-fluoroquinazolin-4-yl)sulfanyl-N,N-dimethylethanamine
CID 133429829
(3-quinazolin-4-ylsulfanylphenyl)methanamine
CID 102818709
5-bromo-N-ethyl-6-(3-fluorophenyl)sulfanylpyrimidin-4-amine
CID 114073920
N-[(4-fluorophenyl)methyl]-5-(6-fluoroquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine
CID 133426576

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline?
The IUPAC name of 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline (CID 133429642) is 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline.
What is the SMILES notation for 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline?
The canonical SMILES for 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline is Fc1cccc(Sc2ncnc3ccc(F)cc23)c1.
What is the InChIKey of 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline?
The InChIKey is RHXWXARTGWHFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F2N2S/c15-9-2-1-3-11(6-9)19-14-12-7-10(16)4-5-13(12)17-8-18-14/h1-8H.
What are the key properties of 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline?
6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline has a molecular weight of 274.30 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-4-(3-fluorophenyl)sulfanylquinazoline is sourced from PubChem (CID 133429642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).