2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol

C20H17FOS — CID 2765147

IUPAC2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol
SMILESOC(CSc1ccc(F)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H17FOS/c21-18-11-13-19(14-12-18)23-15-20(22,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,22H,15H2
InChIKeyUFEHJZPYPTXTQH-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.85
Rot. Bonds5

About 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol

2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol (PubChem CID 2765147) has the molecular formula C20H17FOS and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol.

Molecular Properties

Compound Name2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol
PubChem CID2765147
Molecular FormulaC20H17FOS
Molecular Weight324.42 g/mol
Exact Mass324.10
IUPAC Name2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol
SMILESOC(CSc1ccc(F)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H17FOS/c21-18-11-13-19(14-12-18)23-15-20(22,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,22H,15H2
InChIKeyUFEHJZPYPTXTQH-UHFFFAOYSA-N
XLogP4.85
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol?
The IUPAC name of 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol (CID 2765147) is 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol.
What is the SMILES notation for 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol?
The canonical SMILES for 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol is OC(CSc1ccc(F)cc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol?
The InChIKey is UFEHJZPYPTXTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FOS/c21-18-11-13-19(14-12-18)23-15-20(22,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,22H,15H2.
What are the key properties of 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol?
2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol has a molecular weight of 324.42 g/mol, XLogP of 4.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)sulfanyl-1,1-diphenylethanol is sourced from PubChem (CID 2765147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).