2-[2-(difluoromethyl)phenyl]sulfanylthiophene

C11H8F2S2 — CID 158832126

IUPAC2-[2-(difluoromethyl)phenyl]sulfanylthiophene
SMILESFC(F)c1ccccc1Sc1cccs1
InChIInChI=1S/C11H8F2S2/c12-11(13)8-4-1-2-5-9(8)15-10-6-3-7-14-10/h1-7,11H
InChIKeyIXEDYNZVGBCHDE-UHFFFAOYSA-N
MW242.32 g/mol
LogP4.84
Rot. Bonds3

About 2-[2-(difluoromethyl)phenyl]sulfanylthiophene

2-[2-(difluoromethyl)phenyl]sulfanylthiophene (PubChem CID 158832126) has the molecular formula C11H8F2S2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-[2-(difluoromethyl)phenyl]sulfanylthiophene.

Molecular Properties

Compound Name2-[2-(difluoromethyl)phenyl]sulfanylthiophene
PubChem CID158832126
Molecular FormulaC11H8F2S2
Molecular Weight242.32 g/mol
Exact Mass242.00
IUPAC Name2-[2-(difluoromethyl)phenyl]sulfanylthiophene
SMILESFC(F)c1ccccc1Sc1cccs1
InChIInChI=1S/C11H8F2S2/c12-11(13)8-4-1-2-5-9(8)15-10-6-3-7-14-10/h1-7,11H
InChIKeyIXEDYNZVGBCHDE-UHFFFAOYSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[2-(difluoromethyl)phenyl]sulfanylthiophene 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-[2-(difluoromethyl)phenyl]sulfanylthiophene?
The IUPAC name of 2-[2-(difluoromethyl)phenyl]sulfanylthiophene (CID 158832126) is 2-[2-(difluoromethyl)phenyl]sulfanylthiophene.
What is the SMILES notation for 2-[2-(difluoromethyl)phenyl]sulfanylthiophene?
The canonical SMILES for 2-[2-(difluoromethyl)phenyl]sulfanylthiophene is FC(F)c1ccccc1Sc1cccs1.
What is the InChIKey of 2-[2-(difluoromethyl)phenyl]sulfanylthiophene?
The InChIKey is IXEDYNZVGBCHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2S2/c12-11(13)8-4-1-2-5-9(8)15-10-6-3-7-14-10/h1-7,11H.
What are the key properties of 2-[2-(difluoromethyl)phenyl]sulfanylthiophene?
2-[2-(difluoromethyl)phenyl]sulfanylthiophene has a molecular weight of 242.32 g/mol, XLogP of 4.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(difluoromethyl)phenyl]sulfanylthiophene is sourced from PubChem (CID 158832126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).