1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene

C19H15FOS — CID 119025559

IUPAC1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene
SMILESCc1ccc(S(=O)c2cccc(F)c2-c2ccccc2)cc1
InChIInChI=1S/C19H15FOS/c1-14-10-12-16(13-11-14)22(21)18-9-5-8-17(20)19(18)15-6-3-2-4-7-15/h2-13H,1H3
InChIKeyJVIZTCGZSRYELI-UHFFFAOYSA-N
MW310.39 g/mol
LogP4.97
Rot. Bonds3

About 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene

1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene (PubChem CID 119025559) has the molecular formula C19H15FOS and a molecular weight of 310.39 g/mol. Its IUPAC name is 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene.

Molecular Properties

Compound Name1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene
PubChem CID119025559
Molecular FormulaC19H15FOS
Molecular Weight310.39 g/mol
Exact Mass310.08
IUPAC Name1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene
SMILESCc1ccc(S(=O)c2cccc(F)c2-c2ccccc2)cc1
InChIInChI=1S/C19H15FOS/c1-14-10-12-16(13-11-14)22(21)18-9-5-8-17(20)19(18)15-6-3-2-4-7-15/h2-13H,1H3
InChIKeyJVIZTCGZSRYELI-UHFFFAOYSA-N
XLogP4.97
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.39
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene 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

2-fluoro-6-[(S)-(4-methylphenyl)sulfinyl]benzonitrile
CID 129363821
1-methyl-2-[2-(4-methylphenyl)sulfinylphenyl]benzene
CID 102101536
1-tert-butyl-2-(4-phenylphenyl)sulfinylbenzene
CID 156856490
2-[4-[4-(benzenesulfinyl)phenyl]phenyl]sulfinyl-1,4-dimethylbenzene
CID 59167193
2-chloro-9-(4-methylphenyl)sulfinyl-10-phenylphenanthrene
CID 172559593
trimethyl-[[2-(4-methylphenyl)sulfinylphenyl]methyl]silane
CID 85436146
1-[(1R)-1-bromoethyl]-2-(4-methylphenyl)sulfinylbenzene
CID 102282736
1-(4-methylphenyl)sulfinyl-2-propylbenzene
CID 85436148
ethane;1-methyl-4-(4-methylphenyl)sulfinylbenzene
CID 91610736
1,2,3,4,5-pentafluoro-6-[(E)-2-[3-methyl-2-[2-(4-methylphenyl)sulfinylphenyl]phenyl]ethenyl]benzene
CID 132534081
3-[5-(4-methylphenyl)sulfinylnaphthalen-2-yl]phenol
CID 145481431
(1S,2S)-2-fluoro-2-[2-[(S)-(4-methylphenyl)sulfinyl]phenyl]-1-phenylethanol
CID 135061397

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene?
The IUPAC name of 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene (CID 119025559) is 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene.
What is the SMILES notation for 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene?
The canonical SMILES for 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene is Cc1ccc(S(=O)c2cccc(F)c2-c2ccccc2)cc1.
What is the InChIKey of 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene?
The InChIKey is JVIZTCGZSRYELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FOS/c1-14-10-12-16(13-11-14)22(21)18-9-5-8-17(20)19(18)15-6-3-2-4-7-15/h2-13H,1H3.
What are the key properties of 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene?
1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene has a molecular weight of 310.39 g/mol, XLogP of 4.97, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(4-methylphenyl)sulfinyl-2-phenylbenzene is sourced from PubChem (CID 119025559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).